3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione

C303H314Br2ClF2N29O53S21 — CID 158353592

IUPAC3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione
SMILESC=C1CCC[C@@H](N2Cc3sccc3C2=O)C(=O)C1.C=C1CCC[C@H](N2C(=O)c3ccsc3C2=O)C(=O)C1.C=C1CCC[C@H](N2C(=O)c3csc(N)c3C2=O)C(=O)C1.C=C1CCC[C@H](N2C(=O)c3csc([N+](=O)[O-])c3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3Br)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3C(C)C)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3C(F)F)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3C3CCCC3)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3CN)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3ccsc3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3cscc3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3sc(Br)cc3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3sc(C)cc3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3sccc3C2=O)C(=O)C1.Cc1ccc(NC(=O)NCc2scc3c2CN(C2CCC(=O)CC2=O)C3=O)cc1Cl.Cc1scc2c1CN([C@H]1CC(=O)NC1=O)C2=O.Cc1scc2c1CN([C@H]1CCCC(=O)CC1=O)C2=O.O=C1CCC(N2Cc3sccc3C2=O)C(=O)C1.O=C1CCCCC[C@@H]1N1Cc2sccc2C1=O.O=C1C[C@H](N2Cc3sccc3C2=O)C(=O)N1.[C-]#[N+]c1scc2c1CN([C@H]1CCCC(=C)CC1=O)C2=O
InChIInChI=1S/C21H20ClN3O4S.C19H23NO2S.C17H21NO2S.C15H15F2NO2S.C15H14N2O2S.C15H18N2O2S.C15H17NO2S.2C14H14BrNO2S.C14H12N2O5S.C14H14N2O3S.C14H15NO3S.C14H13NO3S.4C14H15NO2S.C13H15NO2S.C12H11NO3S.C11H10N2O3S.C10H8N2O3S/c1-11-2-3-12(6-16(11)22)24-21(29)23-8-19-14-9-25(20(28)15(14)10-30-19)17-5-4-13(26)7-18(17)27;1-12-5-4-8-16(17(21)9-12)20-10-14-15(19(20)22)11-23-18(14)13-6-2-3-7-13;1-10(2)16-12-8-18(17(20)13(12)9-21-16)14-6-4-5-11(3)7-15(14)19;1-8-3-2-4-11(12(19)5-8)18-6-9-10(15(18)20)7-21-13(9)14(16)17;1-9-4-3-5-12(13(18)6-9)17-7-10-11(15(17)19)8-20-14(10)16-2;1-9-3-2-4-12(13(18)5-9)17-7-10-11(15(17)19)8-20-14(10)6-16;1-9-4-3-5-12(13(17)6-9)16-8-14-11(15(16)18)7-10(2)19-14;1-8-3-2-4-11(12(17)5-8)16-6-9-10(14(16)18)7-19-13(9)15;1-8-3-2-4-10(11(17)5-8)16-7-12-9(14(16)18)6-13(15)19-12;1-7-3-2-4-9(10(17)5-7)15-12(18)8-6-22-14(16(20)21)11(8)13(15)19;1-7-3-2-4-9(10(17)5-7)16-13(18)8-6-20-12(15)11(8)14(16)19;1-8-10-6-15(14(18)11(10)7-19-8)12-4-2-3-9(16)5-13(12)17;1-8-3-2-4-10(11(16)7-8)15-13(17)9-5-6-19-12(9)14(15)18;1-9-3-2-4-12(13(16)5-9)15-6-10-7-18-8-11(10)14(15)17;2*1-9-3-2-4-11(12(16)7-9)15-8-13-10(14(15)17)5-6-18-13;1-9-3-2-4-11(12(16)7-9)15-8-10-5-6-18-13(10)14(15)17;15-11-5-3-1-2-4-10(11)14-8-12-9(13(14)16)6-7-17-12;14-7-1-2-9(10(15)5-7)13-6-11-8(12(13)16)3-4-17-11;1-5-6-3-13(11(16)7(6)4-17-5)8-2-9(14)12-10(8)15;13-8-3-6(9(14)11-8)12-4-7-5(10(12)15)1-2-16-7/h2-3,6,10,17H,4-5,7-9H2,1H3,(H2,23,24,29);11,13,16H,1-10H2;9-10,14H,3-8H2,1-2H3;7,11,14H,1-6H2;8,12H,1,3-7H2;8,12H,1-7,16H2;7,12H,1,3-6,8H2,2H3;7,11H,1-6H2;6,10H,1-5,7H2;6,9H,1-5H2;6,9H,1-5,15H2;7,12H,2-6H2,1H3;5-6,10H,1-4,7H2;7-8,12H,1-6H2;3*5-6,11H,1-4,7-8H2;6-7,10H,1-5,8H2;3-4,9H,1-2,5-6H2;4,8H,2-3H2,1H3,(H,12,14,15);1-2,6H,3-4H2,(H,11,13,14)/t;16-;14-;11-;3*12-;11-;10-;2*9-;12-;10-;12-;3*11-;10-;;8-;6-/m.00000000000001000.00/s1
InChIKeyGSPNFNHZXXBNDC-DLGCOBCWSA-N
MW6116.66 g/mol
LogP55.87
Rot. Bonds29

About 3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione

3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione (PubChem CID 158353592) has the molecular formula C303H314Br2ClF2N29O53S21 and a molecular weight of 6116.66 g/mol. Its IUPAC name is 3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione
PubChem CID158353592
Molecular FormulaC303H314Br2ClF2N29O53S21
Molecular Weight6116.66 g/mol
Exact Mass6108.49
IUPAC Name3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione
SMILESC=C1CCC[C@@H](N2Cc3sccc3C2=O)C(=O)C1.C=C1CCC[C@H](N2C(=O)c3ccsc3C2=O)C(=O)C1.C=C1CCC[C@H](N2C(=O)c3csc(N)c3C2=O)C(=O)C1.C=C1CCC[C@H](N2C(=O)c3csc([N+](=O)[O-])c3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3Br)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3C(C)C)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3C(F)F)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3C3CCCC3)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3CN)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3ccsc3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3cscc3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3sc(Br)cc3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3sc(C)cc3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3sccc3C2=O)C(=O)C1.Cc1ccc(NC(=O)NCc2scc3c2CN(C2CCC(=O)CC2=O)C3=O)cc1Cl.Cc1scc2c1CN([C@H]1CC(=O)NC1=O)C2=O.Cc1scc2c1CN([C@H]1CCCC(=O)CC1=O)C2=O.O=C1CCC(N2Cc3sccc3C2=O)C(=O)C1.O=C1CCCCC[C@@H]1N1Cc2sccc2C1=O.O=C1C[C@H](N2Cc3sccc3C2=O)C(=O)N1.[C-]#[N+]c1scc2c1CN([C@H]1CCCC(=C)CC1=O)C2=O
InChIInChI=1S/C21H20ClN3O4S.C19H23NO2S.C17H21NO2S.C15H15F2NO2S.C15H14N2O2S.C15H18N2O2S.C15H17NO2S.2C14H14BrNO2S.C14H12N2O5S.C14H14N2O3S.C14H15NO3S.C14H13NO3S.4C14H15NO2S.C13H15NO2S.C12H11NO3S.C11H10N2O3S.C10H8N2O3S/c1-11-2-3-12(6-16(11)22)24-21(29)23-8-19-14-9-25(20(28)15(14)10-30-19)17-5-4-13(26)7-18(17)27;1-12-5-4-8-16(17(21)9-12)20-10-14-15(19(20)22)11-23-18(14)13-6-2-3-7-13;1-10(2)16-12-8-18(17(20)13(12)9-21-16)14-6-4-5-11(3)7-15(14)19;1-8-3-2-4-11(12(19)5-8)18-6-9-10(15(18)20)7-21-13(9)14(16)17;1-9-4-3-5-12(13(18)6-9)17-7-10-11(15(17)19)8-20-14(10)16-2;1-9-3-2-4-12(13(18)5-9)17-7-10-11(15(17)19)8-20-14(10)6-16;1-9-4-3-5-12(13(17)6-9)16-8-14-11(15(16)18)7-10(2)19-14;1-8-3-2-4-11(12(17)5-8)16-6-9-10(14(16)18)7-19-13(9)15;1-8-3-2-4-10(11(17)5-8)16-7-12-9(14(16)18)6-13(15)19-12;1-7-3-2-4-9(10(17)5-7)15-12(18)8-6-22-14(16(20)21)11(8)13(15)19;1-7-3-2-4-9(10(17)5-7)16-13(18)8-6-20-12(15)11(8)14(16)19;1-8-10-6-15(14(18)11(10)7-19-8)12-4-2-3-9(16)5-13(12)17;1-8-3-2-4-10(11(16)7-8)15-13(17)9-5-6-19-12(9)14(15)18;1-9-3-2-4-12(13(16)5-9)15-6-10-7-18-8-11(10)14(15)17;2*1-9-3-2-4-11(12(16)7-9)15-8-13-10(14(15)17)5-6-18-13;1-9-3-2-4-11(12(16)7-9)15-8-10-5-6-18-13(10)14(15)17;15-11-5-3-1-2-4-10(11)14-8-12-9(13(14)16)6-7-17-12;14-7-1-2-9(10(15)5-7)13-6-11-8(12(13)16)3-4-17-11;1-5-6-3-13(11(16)7(6)4-17-5)8-2-9(14)12-10(8)15;13-8-3-6(9(14)11-8)12-4-7-5(10(12)15)1-2-16-7/h2-3,6,10,17H,4-5,7-9H2,1H3,(H2,23,24,29);11,13,16H,1-10H2;9-10,14H,3-8H2,1-2H3;7,11,14H,1-6H2;8,12H,1,3-7H2;8,12H,1-7,16H2;7,12H,1,3-6,8H2,2H3;7,11H,1-6H2;6,10H,1-5,7H2;6,9H,1-5H2;6,9H,1-5,15H2;7,12H,2-6H2,1H3;5-6,10H,1-4,7H2;7-8,12H,1-6H2;3*5-6,11H,1-4,7-8H2;6-7,10H,1-5,8H2;3-4,9H,1-2,5-6H2;4,8H,2-3H2,1H3,(H,12,14,15);1-2,6H,3-4H2,(H,11,13,14)/t;16-;14-;11-;3*12-;11-;10-;2*9-;12-;10-;12-;3*11-;10-;;8-;6-/m.00000000000001000.00/s1
InChIKeyGSPNFNHZXXBNDC-DLGCOBCWSA-N
XLogP55.87
TPSA1086.27 Ų
H-Bond Donors6
H-Bond Acceptors76
Rotatable Bonds29
Heavy Atoms411
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5006116.66
LogP ≤ 555.87
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1076

Analyze 3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione with MolForge

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Related Compounds

(4S)-4-(3-chloro-1-methyl-4-oxo-6H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;tris(3-[4-(3-chloro-4-methylphenyl)-3-oxobutyl]-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one);3-cyclopentyl-5-(4-methylidene-2-oxocyclohexyl)thieno[2,3-c]pyrrole-4,6-dione;2-cyclopentyl-5-(6-methylidene-2-oxopiperidin-3-yl)thieno[2,3-c]pyrrole-4,6-dione;3-cyclopentyl-5-(6-methylidene-2-oxopiperidin-3-yl)thieno[3,4-c]pyrrole-4,6-dione;(4S)-4-(3-cyclopentyl-6-oxo-4H-thieno[2,3-c]pyrrol-5-yl)cycloheptane-1,3-dione;3-(difluoromethyl)-5-(4-methylidene-2-oxocyclohexyl)-4H-thieno[3,4-c]pyrrol-6-one;3-methyl-5-(4-methylidene-2-oxocyclohexyl)-4H-thieno[3,4-c]pyrrol-6-one;3-methyl-5-[(1S)-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one
CID 158869428
1-(3-chloro-4-methyl-5-propan-2-ylphenyl)-3-[[5-[(1S)-4-methylidene-2-oxocycloheptyl]-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea
CID 157281457
1-[3-chloro-4-(trifluoromethyl)phenyl]-3-[[5-(4-methylidene-2-oxocycloheptyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea
CID 160671344
1-[[5-(4-methylidene-2-oxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]urea
CID 158245575
3-[4-(5-chloro-2,4-dimethylphenyl)-3-oxobutyl]-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[2,3-c]pyrrol-2-yl]methyl]urea;1-(3-chloro-4-methylphenyl)-3-[[5-[(1S)-4-methylidene-2-oxocycloheptyl]-6-oxo-4H-thieno[2,3-c]pyrrol-2-yl]methyl]urea;1-[(3-chloro-4-methylphenyl)methyl]-3-[[5-[(1S)-4-methylidene-2-oxocycloheptyl]-6-oxo-4H-thieno[2,3-c]pyrrol-2-yl]methyl]urea;3-[4-(3-chloro-4-methylphenyl)-3-oxobutyl]-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-[4-(4-methyl-3-propan-2-ylphenyl)-3-oxobutyl]-4H-thieno[3,4-c]pyrrol-6-one;3-[5-[(1S)-4-methylidene-2-oxocycloheptyl]-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]-N-(6-methyl-3-pyridinyl)propanamide;3-[5-[(1S)-4-methylidene-2-oxocycloheptyl]-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]-N-[4-methyl-3-(trifluoromethyl)phenyl]propanamide
CID 157133283
1-(3-chloro-4-methylphenyl)-3-[[5-(2,6-dioxopiperidin-3-yl)-6-oxo-4H-thieno[2,3-c]pyrrol-3-yl]methyl]urea
CID 135291349
1-[[5-[(3S)-2,7-dioxoazepan-3-yl]-6-methylidene-4H-thieno[3,4-c]pyrrol-3-yl]methyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]urea
CID 157281454
1-[(3-chloro-4-methylphenyl)methyl]-3-[[5-(2,7-dioxoazepan-3-yl)-6-methylidene-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea
CID 158675179
1-(3-chloro-4-methylphenyl)-3-[5-(2,6-dioxopiperidin-3-yl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]urea
CID 134608332
1-(3-chloro-4-methylphenyl)-3-[[2-[(3S)-2,6-dioxopiperidin-3-yl]-1-oxo-3H-isoindol-5-yl]methyl]urea
CID 121225589
1-(3-chloro-4-methoxyphenyl)-3-[[2-(4-methylidene-2-oxocycloheptyl)-1-oxo-3H-isoindol-5-yl]methyl]urea;2-(3-chloro-4-methylphenyl)-N-[[2-(4-methylidene-2-oxocycloheptyl)-1-oxo-3H-isoindol-5-yl]methyl]acetamide;N-[[2-(4-methylidene-2-oxocycloheptyl)-1-oxo-3H-isoindol-5-yl]methyl]-2-(4-methylphenyl)acetamide
CID 158762835
1-(3-chloro-4-methylphenyl)-3-[2-[[2-(2,6-dioxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]sulfanyl]ethyl]urea
CID 155665320

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione?
The IUPAC name of 3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione (CID 158353592) is 3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione.
What is the SMILES notation for 3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione?
The canonical SMILES for 3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione is C=C1CCC[C@@H](N2Cc3sccc3C2=O)C(=O)C1.C=C1CCC[C@H](N2C(=O)c3ccsc3C2=O)C(=O)C1.C=C1CCC[C@H](N2C(=O)c3csc(N)c3C2=O)C(=O)C1.C=C1CCC[C@H](N2C(=O)c3csc([N+](=O)[O-])c3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3Br)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3C(C)C)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3C(F)F)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3C3CCCC3)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3c(csc3CN)C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3ccsc3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3cscc3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3sc(Br)cc3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3sc(C)cc3C2=O)C(=O)C1.C=C1CCC[C@H](N2Cc3sccc3C2=O)C(=O)C1.Cc1ccc(NC(=O)NCc2scc3c2CN(C2CCC(=O)CC2=O)C3=O)cc1Cl.Cc1scc2c1CN([C@H]1CC(=O)NC1=O)C2=O.Cc1scc2c1CN([C@H]1CCCC(=O)CC1=O)C2=O.O=C1CCC(N2Cc3sccc3C2=O)C(=O)C1.O=C1CCCCC[C@@H]1N1Cc2sccc2C1=O.O=C1C[C@H](N2Cc3sccc3C2=O)C(=O)N1.[C-]#[N+]c1scc2c1CN([C@H]1CCCC(=C)CC1=O)C2=O.
What is the InChIKey of 3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione?
The InChIKey is GSPNFNHZXXBNDC-DLGCOBCWSA-N. The full InChI is InChI=1S/C21H20ClN3O4S.C19H23NO2S.C17H21NO2S.C15H15F2NO2S.C15H14N2O2S.C15H18N2O2S.C15H17NO2S.2C14H14BrNO2S.C14H12N2O5S.C14H14N2O3S.C14H15NO3S.C14H13NO3S.4C14H15NO2S.C13H15NO2S.C12H11NO3S.C11H10N2O3S.C10H8N2O3S/c1-11-2-3-12(6-16(11)22)24-21(29)23-8-19-14-9-25(20(28)15(14)10-30-19)17-5-4-13(26)7-18(17)27;1-12-5-4-8-16(17(21)9-12)20-10-14-15(19(20)22)11-23-18(14)13-6-2-3-7-13;1-10(2)16-12-8-18(17(20)13(12)9-21-16)14-6-4-5-11(3)7-15(14)19;1-8-3-2-4-11(12(19)5-8)18-6-9-10(15(18)20)7-21-13(9)14(16)17;1-9-4-3-5-12(13(18)6-9)17-7-10-11(15(17)19)8-20-14(10)16-2;1-9-3-2-4-12(13(18)5-9)17-7-10-11(15(17)19)8-20-14(10)6-16;1-9-4-3-5-12(13(17)6-9)16-8-14-11(15(16)18)7-10(2)19-14;1-8-3-2-4-11(12(17)5-8)16-6-9-10(14(16)18)7-19-13(9)15;1-8-3-2-4-10(11(17)5-8)16-7-12-9(14(16)18)6-13(15)19-12;1-7-3-2-4-9(10(17)5-7)15-12(18)8-6-22-14(16(20)21)11(8)13(15)19;1-7-3-2-4-9(10(17)5-7)16-13(18)8-6-20-12(15)11(8)14(16)19;1-8-10-6-15(14(18)11(10)7-19-8)12-4-2-3-9(16)5-13(12)17;1-8-3-2-4-10(11(16)7-8)15-13(17)9-5-6-19-12(9)14(15)18;1-9-3-2-4-12(13(16)5-9)15-6-10-7-18-8-11(10)14(15)17;2*1-9-3-2-4-11(12(16)7-9)15-8-13-10(14(15)17)5-6-18-13;1-9-3-2-4-11(12(16)7-9)15-8-10-5-6-18-13(10)14(15)17;15-11-5-3-1-2-4-10(11)14-8-12-9(13(14)16)6-7-17-12;14-7-1-2-9(10(15)5-7)13-6-11-8(12(13)16)3-4-17-11;1-5-6-3-13(11(16)7(6)4-17-5)8-2-9(14)12-10(8)15;13-8-3-6(9(14)11-8)12-4-7-5(10(12)15)1-2-16-7/h2-3,6,10,17H,4-5,7-9H2,1H3,(H2,23,24,29);11,13,16H,1-10H2;9-10,14H,3-8H2,1-2H3;7,11,14H,1-6H2;8,12H,1,3-7H2;8,12H,1-7,16H2;7,12H,1,3-6,8H2,2H3;7,11H,1-6H2;6,10H,1-5,7H2;6,9H,1-5H2;6,9H,1-5,15H2;7,12H,2-6H2,1H3;5-6,10H,1-4,7H2;7-8,12H,1-6H2;3*5-6,11H,1-4,7-8H2;6-7,10H,1-5,8H2;3-4,9H,1-2,5-6H2;4,8H,2-3H2,1H3,(H,12,14,15);1-2,6H,3-4H2,(H,11,13,14)/t;16-;14-;11-;3*12-;11-;10-;2*9-;12-;10-;12-;3*11-;10-;;8-;6-/m.00000000000001000.00/s1.
What are the key properties of 3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione?
3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione has a molecular weight of 6116.66 g/mol, XLogP of 55.87, 29 rotatable bonds, 6 hydrogen bond donors, and 76 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[3,4-c]pyrrole-4,6-dione;3-(aminomethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;2-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;3-bromo-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;1-(3-chloro-4-methylphenyl)-3-[[5-(2,4-dioxocyclohexyl)-6-oxo-4H-thieno[3,4-c]pyrrol-3-yl]methyl]urea;3-cyclopentyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-(difluoromethyl)-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;3-isocyano-5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-nitrothieno[3,4-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-3-propan-2-yl-4H-thieno[3,4-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]thieno[2,3-c]pyrrole-4,6-dione;5-[(1S)-4-methylidene-2-oxocycloheptyl]-4H-thieno[2,3-c]pyrrol-6-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1R)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[3,4-c]pyrrol-4-one;2-methyl-5-[(1S)-4-methylidene-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;(4S)-4-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)cycloheptane-1,3-dione;(3S)-3-(3-methyl-6-oxo-4H-thieno[3,4-c]pyrrol-5-yl)pyrrolidine-2,5-dione;5-[(1S)-2-oxocycloheptyl]-6H-thieno[2,3-c]pyrrol-4-one;4-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)cyclohexane-1,3-dione;(3S)-3-(4-oxo-6H-thieno[2,3-c]pyrrol-5-yl)pyrrolidine-2,5-dione is sourced from PubChem (CID 158353592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).