1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate

C239H235ClF8N32O31S4 — CID 161211579

IUPAC1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate
SMILESC=CCNC(=O)Nc1cccc(-c2c(C#N)c3ccc(OC)cc3n2Cc2ccccc2)c1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC(F)F)cc3n2C2CCC2)cc1.CC(C)S(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC(F)F)cc3n2C2CCC2)cc1.CCCNC(=O)Nc1cccc(-c2c(C#N)c3ccc(OC)cc3n2Cc2ccccc2)c1.CCn1c(-c2cc(N3CCOC3=O)ccc2F)c(C#N)c2ccc(OC(C)C)cc21.CCn1c(-c2ccc(F)c(N3CCOC3=O)c2)c(C#N)c2ccc(OC(C)C)cc21.CCn1c(-c2ccc(N(CCOC(C)=O)S(C)(=O)=O)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(N(CCOC)S(C)(=O)=O)cc2)c(C#N)c2ccc(OC)cc21.COc1ccc2c(C#N)c(-c3cccc(NC(=O)OCCCl)c3)n(C3CCCC3)c2c1.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CCC2)c2cc(OC(F)F)ccc12
InChIInChI=1S/C27H26N4O2.C27H24N4O2.C24H24ClN3O3.C24H23F2N3O3.C23H21F2N3O3S.C23H23F2N3O3S.2C23H22FN3O3.C23H25N3O5S.C22H25N3O4S/c2*1-3-14-29-27(32)30-21-11-7-10-20(15-21)26-24(17-28)23-13-12-22(33-2)16-25(23)31(26)18-19-8-5-4-6-9-19;1-30-19-9-10-20-21(15-26)23(28(22(20)14-19)18-7-2-3-8-18)16-5-4-6-17(13-16)27-24(29)31-12-11-25;1-14(2)31-24(30)28-16-8-6-15(7-9-16)22-20(13-27)19-11-10-18(32-23(25)26)12-21(19)29(22)17-4-3-5-17;24-23(25)31-17-8-11-19-20(13-26)22(28(21(19)12-17)16-2-1-3-16)14-4-6-15(7-5-14)27-32(29,30)18-9-10-18;1-14(2)32(29,30)27-16-8-6-15(7-9-16)22-20(13-26)19-11-10-18(31-23(24)25)12-21(19)28(22)17-4-3-5-17;1-4-26-20-12-16(30-14(2)3)6-7-17(20)18(13-25)22(26)15-5-8-19(24)21(11-15)27-9-10-29-23(27)28;1-4-26-21-12-16(30-14(2)3)6-7-17(21)19(13-25)22(26)18-11-15(5-8-20(18)24)27-9-10-29-23(27)28;1-5-25-22-14-19(30-3)10-11-20(22)21(15-24)23(25)17-6-8-18(9-7-17)26(32(4,28)29)12-13-31-16(2)27;1-5-24-21-14-18(29-3)10-11-19(21)20(15-23)22(24)16-6-8-17(9-7-16)25(12-13-28-2)30(4,26)27/h4-13,15-16H,3,14,18H2,1-2H3,(H2,29,30,32);3-13,15-16H,1,14,18H2,2H3,(H2,29,30,32);4-6,9-10,13-14,18H,2-3,7-8,11-12H2,1H3,(H,27,29);6-12,14,17,23H,3-5H2,1-2H3,(H,28,30);4-8,11-12,16,18,23,27H,1-3,9-10H2;6-12,14,17,23,27H,3-5H2,1-2H3;2*5-8,11-12,14H,4,9-10H2,1-3H3;6-11,14H,5,12-13H2,1-4H3;6-11,14H,5,12-13H2,1-4H3
InChIKeyUWHOPTDXSOUIDV-UHFFFAOYSA-N
MW4367.41 g/mol
LogP52.26
Rot. Bonds66

About 1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate

1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate (PubChem CID 161211579) has the molecular formula C239H235ClF8N32O31S4 and a molecular weight of 4367.41 g/mol. Its IUPAC name is 1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate.

Molecular Properties

Compound Name1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate
PubChem CID161211579
Molecular FormulaC239H235ClF8N32O31S4
Molecular Weight4367.41 g/mol
Exact Mass4363.62
IUPAC Name1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate
SMILESC=CCNC(=O)Nc1cccc(-c2c(C#N)c3ccc(OC)cc3n2Cc2ccccc2)c1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC(F)F)cc3n2C2CCC2)cc1.CC(C)S(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC(F)F)cc3n2C2CCC2)cc1.CCCNC(=O)Nc1cccc(-c2c(C#N)c3ccc(OC)cc3n2Cc2ccccc2)c1.CCn1c(-c2cc(N3CCOC3=O)ccc2F)c(C#N)c2ccc(OC(C)C)cc21.CCn1c(-c2ccc(F)c(N3CCOC3=O)c2)c(C#N)c2ccc(OC(C)C)cc21.CCn1c(-c2ccc(N(CCOC(C)=O)S(C)(=O)=O)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(N(CCOC)S(C)(=O)=O)cc2)c(C#N)c2ccc(OC)cc21.COc1ccc2c(C#N)c(-c3cccc(NC(=O)OCCCl)c3)n(C3CCCC3)c2c1.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CCC2)c2cc(OC(F)F)ccc12
InChIInChI=1S/C27H26N4O2.C27H24N4O2.C24H24ClN3O3.C24H23F2N3O3.C23H21F2N3O3S.C23H23F2N3O3S.2C23H22FN3O3.C23H25N3O5S.C22H25N3O4S/c2*1-3-14-29-27(32)30-21-11-7-10-20(15-21)26-24(17-28)23-13-12-22(33-2)16-25(23)31(26)18-19-8-5-4-6-9-19;1-30-19-9-10-20-21(15-26)23(28(22(20)14-19)18-7-2-3-8-18)16-5-4-6-17(13-16)27-24(29)31-12-11-25;1-14(2)31-24(30)28-16-8-6-15(7-9-16)22-20(13-27)19-11-10-18(32-23(25)26)12-21(19)29(22)17-4-3-5-17;24-23(25)31-17-8-11-19-20(13-26)22(28(21(19)12-17)16-2-1-3-16)14-4-6-15(7-5-14)27-32(29,30)18-9-10-18;1-14(2)32(29,30)27-16-8-6-15(7-9-16)22-20(13-26)19-11-10-18(31-23(24)25)12-21(19)28(22)17-4-3-5-17;1-4-26-20-12-16(30-14(2)3)6-7-17(20)18(13-25)22(26)15-5-8-19(24)21(11-15)27-9-10-29-23(27)28;1-4-26-21-12-16(30-14(2)3)6-7-17(21)19(13-25)22(26)18-11-15(5-8-20(18)24)27-9-10-29-23(27)28;1-5-25-22-14-19(30-3)10-11-20(22)21(15-24)23(25)17-6-8-18(9-7-17)26(32(4,28)29)12-13-31-16(2)27;1-5-24-21-14-18(29-3)10-11-19(21)20(15-23)22(24)16-6-8-17(9-7-16)25(12-13-28-2)30(4,26)27/h4-13,15-16H,3,14,18H2,1-2H3,(H2,29,30,32);3-13,15-16H,1,14,18H2,2H3,(H2,29,30,32);4-6,9-10,13-14,18H,2-3,7-8,11-12H2,1H3,(H,27,29);6-12,14,17,23H,3-5H2,1-2H3,(H,28,30);4-8,11-12,16,18,23,27H,1-3,9-10H2;6-12,14,17,23,27H,3-5H2,1-2H3;2*5-8,11-12,14H,4,9-10H2,1-3H3;6-11,14H,5,12-13H2,1-4H3;6-11,14H,5,12-13H2,1-4H3
InChIKeyUWHOPTDXSOUIDV-UHFFFAOYSA-N
XLogP52.26
TPSA800.13 Ų
H-Bond Donors8
H-Bond Acceptors51
Rotatable Bonds66
Heavy Atoms315
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004367.41
LogP ≤ 552.26
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1051

Analyze 1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propylurea;1-butyl-3-[3-[3-cyano-1-ethyl-6-(3-morpholin-4-ylpropoxy)indol-2-yl]phenyl]urea;1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]-3-prop-2-enylurea;ethyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate;ethyl N-[4-(3-cyano-6-ethoxy-1-propan-2-ylindol-2-yl)phenyl]carbamate;ethyl N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]carbamate;1-ethyl-6-(3-morpholin-4-ylpropoxy)-2-[3-(2-oxoimidazolidin-1-yl)phenyl]indole-3-carbonitrile;1-ethyl-6-(3-morpholin-4-ylpropoxy)-2-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]indole-3-carbonitrile;2-fluoroethyl N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]carbamate;2-methylpropyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate;propyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate
CID 161061936
N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]cyclopropanesulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;1-[3-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-3-propylurea;ethyl N-[3-(3-cyano-1-ethyl-6-propan-2-yloxyindol-2-yl)-4-fluorophenyl]carbamate;ethyl N-[5-(3-cyano-1-ethyl-6-propan-2-yloxyindol-2-yl)-2-methoxyphenyl]carbamate
CID 162082963
N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]cyclopropanesulfonamide;N-[4-(5-chloro-3-cyano-1-ethylindol-2-yl)phenyl]propane-1-sulfonamide;2-methoxyethyl N-[3-(3-cyano-1-ethyl-5-morpholin-4-ylindol-2-yl)phenyl]carbamate;prop-2-enyl N-[3-(3-cyano-1-ethyl-6-propan-2-yloxyindol-2-yl)phenyl]carbamate;propyl N-[3-(3-cyano-1-ethyl-5-morpholin-4-ylindol-2-yl)phenyl]carbamate;propyl N-[3-(3-cyano-1-ethyl-6-propan-2-yloxyindol-2-yl)phenyl]carbamate
CID 159344054
3-chloro-N-[4-(3-cyano-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]propane-1-sulfonamide;3-chloro-N-[4-[3-cyano-6-(difluoromethoxy)-1-ethylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]cyclopropanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-6-(difluoromethoxy)-1-ethylindol-2-yl]phenyl]propane-2-sulfonamide
CID 158802782
3-chloro-N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]cyclopropanesulfonamide;N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-N-ethylethanesulfonamide;1-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]-3-(2-phenylethyl)urea;methyl N-[4-(3-cyano-6-methoxy-1-propylindol-2-yl)phenyl]carbamate
CID 159304990
2-fluoroethyl N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]carbamate;2-methoxyethyl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate;2-methoxyethyl N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]carbamate
CID 157420704
benzyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate;tert-butyl N-[4-(3-cyano-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;butyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate;1-[4-(3-cyano-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-methoxyindole-3-carbonitrile;2,2-dimethylpropyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate;ethyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate;1-ethyl-2-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-(3-pyrrolidin-1-ylpropoxy)indole-3-carbonitrile;2-methylpropyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate;propyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate
CID 161170789
3-chloro-N-[4-[3-cyano-1-ethyl-6-(2-fluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;2-chloroethyl N-[3-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-ethyl-6-(2-fluoroethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-ethyl-6-(2-fluoroethoxy)indol-2-yl]phenyl]propane-1-sulfonamide;2-methoxyethyl N-[3-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]carbamate;prop-2-ynyl N-[3-(3-cyano-6-methoxy-1-propan-2-ylindol-2-yl)phenyl]carbamate
CID 159593330
1-[4-(1-butyl-3-cyano-6-ethoxyindol-2-yl)phenyl]-3-propylurea;1-butyl-3-[3-[3-cyano-1-ethyl-6-(3-morpholin-4-ylpropoxy)indol-2-yl]phenyl]urea;1-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]-3-prop-2-enylurea;1-[4-[3-cyano-6-ethoxy-1-(2-methylpropyl)indol-2-yl]phenyl]-3-ethylurea;1-[4-[3-cyano-6-ethoxy-1-(2-methylpropyl)indol-2-yl]phenyl]-3-propylurea;ethyl N-[4-(3-cyano-6-ethoxy-1-propan-2-ylindol-2-yl)phenyl]carbamate;ethyl N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]carbamate;1-ethyl-6-(3-morpholin-4-ylpropoxy)-2-[3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]indole-3-carbonitrile;1-ethyl-6-(3-morpholin-4-ylpropoxy)-2-[3-(2-oxopyrrolidin-1-yl)phenyl]indole-3-carbonitrile;2-fluoroethyl N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]carbamate;methyl N-[4-(3-cyano-6-ethoxy-1-propylindol-2-yl)phenyl]carbamate;2-methylpropyl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate
CID 159202023
benzyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate;butyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate;1-[4-(3-cyano-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-methoxyindole-3-carbonitrile;2,2-dimethylpropyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate;1-ethyl-2-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-(3-pyrrolidin-1-ylpropoxy)indole-3-carbonitrile;1-ethyl-2-[4-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-[3-(1,2,4-triazol-1-yl)propoxy]indole-3-carbonitrile;2-methylpropyl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-methoxyindol-2-yl)phenyl]carbamate
CID 158584426
N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]cyclopropanesulfonamide;2-fluoroethyl N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]carbamate;2-methoxyethyl N-[4-[3-cyano-6-(difluoromethoxy)-1-propylindol-2-yl]phenyl]carbamate
CID 161097153
2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate
CID 59426351

Frequently Asked Questions

What is the IUPAC name of 1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate?
The IUPAC name of 1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate (CID 161211579) is 1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate.
What is the SMILES notation for 1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate?
The canonical SMILES for 1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate is C=CCNC(=O)Nc1cccc(-c2c(C#N)c3ccc(OC)cc3n2Cc2ccccc2)c1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OC(F)F)cc3n2C2CCC2)cc1.CC(C)S(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC(F)F)cc3n2C2CCC2)cc1.CCCNC(=O)Nc1cccc(-c2c(C#N)c3ccc(OC)cc3n2Cc2ccccc2)c1.CCn1c(-c2cc(N3CCOC3=O)ccc2F)c(C#N)c2ccc(OC(C)C)cc21.CCn1c(-c2ccc(F)c(N3CCOC3=O)c2)c(C#N)c2ccc(OC(C)C)cc21.CCn1c(-c2ccc(N(CCOC(C)=O)S(C)(=O)=O)cc2)c(C#N)c2ccc(OC)cc21.CCn1c(-c2ccc(N(CCOC)S(C)(=O)=O)cc2)c(C#N)c2ccc(OC)cc21.COc1ccc2c(C#N)c(-c3cccc(NC(=O)OCCCl)c3)n(C3CCCC3)c2c1.N#Cc1c(-c2ccc(NS(=O)(=O)C3CC3)cc2)n(C2CCC2)c2cc(OC(F)F)ccc12.
What is the InChIKey of 1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate?
The InChIKey is UWHOPTDXSOUIDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26N4O2.C27H24N4O2.C24H24ClN3O3.C24H23F2N3O3.C23H21F2N3O3S.C23H23F2N3O3S.2C23H22FN3O3.C23H25N3O5S.C22H25N3O4S/c2*1-3-14-29-27(32)30-21-11-7-10-20(15-21)26-24(17-28)23-13-12-22(33-2)16-25(23)31(26)18-19-8-5-4-6-9-19;1-30-19-9-10-20-21(15-26)23(28(22(20)14-19)18-7-2-3-8-18)16-5-4-6-17(13-16)27-24(29)31-12-11-25;1-14(2)31-24(30)28-16-8-6-15(7-9-16)22-20(13-27)19-11-10-18(32-23(25)26)12-21(19)29(22)17-4-3-5-17;24-23(25)31-17-8-11-19-20(13-26)22(28(21(19)12-17)16-2-1-3-16)14-4-6-15(7-5-14)27-32(29,30)18-9-10-18;1-14(2)32(29,30)27-16-8-6-15(7-9-16)22-20(13-26)19-11-10-18(31-23(24)25)12-21(19)28(22)17-4-3-5-17;1-4-26-20-12-16(30-14(2)3)6-7-17(20)18(13-25)22(26)15-5-8-19(24)21(11-15)27-9-10-29-23(27)28;1-4-26-21-12-16(30-14(2)3)6-7-17(21)19(13-25)22(26)18-11-15(5-8-20(18)24)27-9-10-29-23(27)28;1-5-25-22-14-19(30-3)10-11-20(22)21(15-24)23(25)17-6-8-18(9-7-17)26(32(4,28)29)12-13-31-16(2)27;1-5-24-21-14-18(29-3)10-11-19(21)20(15-23)22(24)16-6-8-17(9-7-16)25(12-13-28-2)30(4,26)27/h4-13,15-16H,3,14,18H2,1-2H3,(H2,29,30,32);3-13,15-16H,1,14,18H2,2H3,(H2,29,30,32);4-6,9-10,13-14,18H,2-3,7-8,11-12H2,1H3,(H,27,29);6-12,14,17,23H,3-5H2,1-2H3,(H,28,30);4-8,11-12,16,18,23,27H,1-3,9-10H2;6-12,14,17,23,27H,3-5H2,1-2H3;2*5-8,11-12,14H,4,9-10H2,1-3H3;6-11,14H,5,12-13H2,1-4H3;6-11,14H,5,12-13H2,1-4H3.
What are the key properties of 1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate?
1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate has a molecular weight of 4367.41 g/mol, XLogP of 52.26, 66 rotatable bonds, 8 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-prop-2-enylurea;1-[3-(1-benzyl-3-cyano-6-methoxyindol-2-yl)phenyl]-3-propylurea;2-chloroethyl N-[3-(3-cyano-1-cyclopentyl-6-methoxyindol-2-yl)phenyl]carbamate;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]cyclopropanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;2-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)-N-methylsulfonylanilino]ethyl acetate;N-[4-(3-cyano-1-ethyl-6-methoxyindol-2-yl)phenyl]-N-(2-methoxyethyl)methanesulfonamide;1-ethyl-2-[2-fluoro-5-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;1-ethyl-2-[4-fluoro-3-(2-oxo-1,3-oxazolidin-3-yl)phenyl]-6-propan-2-yloxyindole-3-carbonitrile;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate is sourced from PubChem (CID 161211579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).