About 5-amino-3,4-dimethyl-N-[(1-oxo-2-propan-2-yl-3H-isoindol-5-yl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(pyridine-4-carbonyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-methylsulfonylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone;5-amino-N-[(1,1-dioxothian-4-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-hexanoylazetidin-3-yl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;phenyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate
5-amino-3,4-dimethyl-N-[(1-oxo-2-propan-2-yl-3H-isoindol-5-yl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(pyridine-4-carbonyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-methylsulfonylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone;5-amino-N-[(1,1-dioxothian-4-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-hexanoylazetidin-3-yl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;phenyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate (PubChem CID 159081056) has the molecular formula C122H139N33O16S10
and a molecular weight of 2644.34 g/mol. Its IUPAC name is 5-amino-3,4-dimethyl-N-[(1-oxo-2-propan-2-yl-3H-isoindol-5-yl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(pyridine-4-carbonyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-methylsulfonylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone;5-amino-N-[(1,1-dioxothian-4-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-hexanoylazetidin-3-yl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;phenyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate.
Frequently Asked Questions
What is the IUPAC name of 5-amino-3,4-dimethyl-N-[(1-oxo-2-propan-2-yl-3H-isoindol-5-yl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(pyridine-4-carbonyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-methylsulfonylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone;5-amino-N-[(1,1-dioxothian-4-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-hexanoylazetidin-3-yl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;phenyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate?
The IUPAC name of 5-amino-3,4-dimethyl-N-[(1-oxo-2-propan-2-yl-3H-isoindol-5-yl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(pyridine-4-carbonyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-methylsulfonylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone;5-amino-N-[(1,1-dioxothian-4-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-hexanoylazetidin-3-yl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;phenyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate (CID 159081056) is 5-amino-3,4-dimethyl-N-[(1-oxo-2-propan-2-yl-3H-isoindol-5-yl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(pyridine-4-carbonyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-methylsulfonylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone;5-amino-N-[(1,1-dioxothian-4-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-hexanoylazetidin-3-yl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;phenyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate.
What is the SMILES notation for 5-amino-3,4-dimethyl-N-[(1-oxo-2-propan-2-yl-3H-isoindol-5-yl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(pyridine-4-carbonyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-methylsulfonylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone;5-amino-N-[(1,1-dioxothian-4-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-hexanoylazetidin-3-yl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;phenyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate?
The canonical SMILES for 5-amino-3,4-dimethyl-N-[(1-oxo-2-propan-2-yl-3H-isoindol-5-yl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(pyridine-4-carbonyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-methylsulfonylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone;5-amino-N-[(1,1-dioxothian-4-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-hexanoylazetidin-3-yl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;phenyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate is CCCCCC(=O)N1CC(NC(=O)c2sc3nnc(C)c(C)c3c2N)C1.Cc1nnc2sc(C(=O)N3CC(S(C)(=O)=O)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)N3CC(Sc4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CN(C(=O)Oc4ccccc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NC3CN(C(=O)c4ccncc4)C3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCC3CCS(=O)(=O)CC3)c(N)c2c1C.Cc1nnc2sc(C(=O)NCc3ccc4c(c3)CN(C(C)C)C4=O)c(N)c2c1C.
What is the InChIKey of 5-amino-3,4-dimethyl-N-[(1-oxo-2-propan-2-yl-3H-isoindol-5-yl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(pyridine-4-carbonyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-methylsulfonylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone;5-amino-N-[(1,1-dioxothian-4-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-hexanoylazetidin-3-yl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;phenyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate?
The InChIKey is KAVYXSPJENERMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O2S.C19H19N5O3S.C18H18N6O2S.C18H25N5O2S.C18H18N4OS2.C15H20N4O3S2.C13H16N4O3S2/c1-10(2)26-9-14-7-13(5-6-15(14)21(26)28)8-23-19(27)18-17(22)16-11(3)12(4)24-25-20(16)29-18;1-10-11(2)22-23-18-14(10)15(20)16(28-18)17(25)21-12-8-24(9-12)19(26)27-13-6-4-3-5-7-13;1-9-10(2)22-23-17-13(9)14(19)15(27-17)16(25)21-12-7-24(8-12)18(26)11-3-5-20-6-4-11;1-4-5-6-7-13(24)23-8-12(9-23)20-17(25)16-15(19)14-10(2)11(3)21-22-18(14)26-16;1-10-11(2)20-21-17-14(10)15(19)16(25-17)18(23)22-8-13(9-22)24-12-6-4-3-5-7-12;1-8-9(2)18-19-15-11(8)12(16)13(23-15)14(20)17-7-10-3-5-24(21,22)6-4-10;1-6-7(2)15-16-12-9(6)10(14)11(21-12)13(18)17-4-8(5-17)22(3,19)20/h5-7,10H,8-9,22H2,1-4H3,(H,23,27);3-7,12H,8-9,20H2,1-2H3,(H,21,25);3-6,12H,7-8,19H2,1-2H3,(H,21,25);12H,4-9,19H2,1-3H3,(H,20,25);3-7,13H,8-9,19H2,1-2H3;10H,3-7,16H2,1-2H3,(H,17,20);8H,4-5,14H2,1-3H3.
What are the key properties of 5-amino-3,4-dimethyl-N-[(1-oxo-2-propan-2-yl-3H-isoindol-5-yl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(pyridine-4-carbonyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-methylsulfonylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone;5-amino-N-[(1,1-dioxothian-4-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-hexanoylazetidin-3-yl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;phenyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate?
5-amino-3,4-dimethyl-N-[(1-oxo-2-propan-2-yl-3H-isoindol-5-yl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(pyridine-4-carbonyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-methylsulfonylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone;5-amino-N-[(1,1-dioxothian-4-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-hexanoylazetidin-3-yl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;phenyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate has a molecular weight of 2644.34 g/mol, XLogP of 15.35, 24 rotatable bonds, 12 hydrogen bond donors, and 46 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-3,4-dimethyl-N-[(1-oxo-2-propan-2-yl-3H-isoindol-5-yl)methyl]thieno[2,3-c]pyridazine-6-carboxamide;5-amino-3,4-dimethyl-N-[1-(pyridine-4-carbonyl)azetidin-3-yl]thieno[2,3-c]pyridazine-6-carboxamide;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-methylsulfonylazetidin-1-yl)methanone;(5-amino-3,4-dimethylthieno[2,3-c]pyridazin-6-yl)-(3-phenylsulfanylazetidin-1-yl)methanone;5-amino-N-[(1,1-dioxothian-4-yl)methyl]-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;5-amino-N-(1-hexanoylazetidin-3-yl)-3,4-dimethylthieno[2,3-c]pyridazine-6-carboxamide;phenyl 3-[(5-amino-3,4-dimethylthieno[2,3-c]pyridazine-6-carbonyl)amino]azetidine-1-carboxylate is sourced from PubChem (CID 159081056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).