tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate

C274H285Cl2F4N39O23S7 — CID 157153677

IUPACtert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate
SMILESCC(C)(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCS(C)(=O)=O)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(N4CCCCC4)cc3n2C2CCC2)cc1.CC(C)S(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(N4CCCC4)cc3n2C2CCC2)cc1.CC(C)S(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(N4CCCCC4)cc3n2C2CCC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3cc(Oc4ccccn4)ccc3n2C2CCC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ncccc4Cl)cc3n2C2CCC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(Cc4nccc(C)n4)cc3n2CC2CC2)cc1.CCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(N4CCCCC4)cc3n2C2CCC2)cc1.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ncccc4Cl)cc3n2C2CCC2)cc1)C1CC1.N#Cc1c(-c2ccc(NCc3ccccc3C(F)(F)F)cc2)n(C2CCC2)c2cc(OCCF)ccc12
InChIInChI=1S/C30H27ClN4O2.C29H25F4N3O.C28H29N5O2S.C28H32N4O2.C27H25ClN4O2S.C27H26N4O3S.C27H32N4O2S.2C26H30N4O2S.C26H29N3O5S/c1-18(19-7-8-19)37-30(36)34-22-12-9-20(10-13-22)29-25(17-32)24-14-11-21(28-26(31)6-3-15-33-28)16-27(24)35(29)23-4-2-5-23;30-14-15-37-23-12-13-24-25(17-34)28(36(27(24)16-23)22-5-3-6-22)19-8-10-21(11-9-19)35-18-20-4-1-2-7-26(20)29(31,32)33;1-3-14-36(34,35)32-23-9-7-22(8-10-23)28-25(17-29)24-11-6-21(16-27-30-13-12-19(2)31-27)15-26(24)33(28)18-20-4-5-20;1-19(2)34-28(33)30-21-11-9-20(10-12-21)27-25(18-29)24-14-13-23(31-15-4-3-5-16-31)17-26(24)32(27)22-7-6-8-22;1-2-15-35(33,34)31-20-11-8-18(9-12-20)27-23(17-29)22-13-10-19(26-24(28)7-4-14-30-26)16-25(22)32(27)21-5-3-6-21;1-2-16-35(32,33)30-20-11-9-19(10-12-20)27-24(18-28)23-17-22(34-26-8-3-4-15-29-26)13-14-25(23)31(27)21-6-5-7-21;1-19(2)34(32,33)29-21-11-9-20(10-12-21)27-25(18-28)24-14-13-23(30-15-4-3-5-16-30)17-26(24)31(27)22-7-6-8-22;1-18(2)33(31,32)28-20-10-8-19(9-11-20)26-24(17-27)23-13-12-22(29-14-3-4-15-29)16-25(23)30(26)21-6-5-7-21;1-2-33(31,32)28-20-11-9-19(10-12-20)26-24(18-27)23-14-13-22(29-15-4-3-5-16-29)17-25(23)30(26)21-7-6-8-21;1-26(2,3)34-25(30)28-18-10-8-17(9-11-18)24-22(15-27)21-13-12-20(33-16-35(4,31)32)14-23(21)29(24)19-6-5-7-19/h3,6,9-16,18-19,23H,2,4-5,7-8H2,1H3,(H,34,36);1-2,4,7-13,16,22,35H,3,5-6,14-15,18H2;6-13,15,20,32H,3-5,14,16,18H2,1-2H3;9-14,17,19,22H,3-8,15-16H2,1-2H3,(H,30,33);4,7-14,16,21,31H,2-3,5-6,15H2,1H3;3-4,8-15,17,21,30H,2,5-7,16H2,1H3;9-14,17,19,22,29H,3-8,15-16H2,1-2H3;8-13,16,18,21,28H,3-7,14-15H2,1-2H3;9-14,17,21,28H,2-8,15-16H2,1H3;8-14,19H,5-7,16H2,1-4H3,(H,28,30)/t18-;;;;;;;;;/m1........./s1
InChIKeyALOBIMBJTQFSJD-RJYOUJLLSA-N
MW4863.91 g/mol
LogP64.14
Rot. Bonds67

About tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate

tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate (PubChem CID 157153677) has the molecular formula C274H285Cl2F4N39O23S7 and a molecular weight of 4863.91 g/mol. Its IUPAC name is tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate
PubChem CID157153677
Molecular FormulaC274H285Cl2F4N39O23S7
Molecular Weight4863.91 g/mol
Exact Mass4858.97
IUPAC Nametert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate
SMILESCC(C)(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCS(C)(=O)=O)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(N4CCCCC4)cc3n2C2CCC2)cc1.CC(C)S(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(N4CCCC4)cc3n2C2CCC2)cc1.CC(C)S(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(N4CCCCC4)cc3n2C2CCC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3cc(Oc4ccccn4)ccc3n2C2CCC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ncccc4Cl)cc3n2C2CCC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(Cc4nccc(C)n4)cc3n2CC2CC2)cc1.CCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(N4CCCCC4)cc3n2C2CCC2)cc1.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ncccc4Cl)cc3n2C2CCC2)cc1)C1CC1.N#Cc1c(-c2ccc(NCc3ccccc3C(F)(F)F)cc2)n(C2CCC2)c2cc(OCCF)ccc12
InChIInChI=1S/C30H27ClN4O2.C29H25F4N3O.C28H29N5O2S.C28H32N4O2.C27H25ClN4O2S.C27H26N4O3S.C27H32N4O2S.2C26H30N4O2S.C26H29N3O5S/c1-18(19-7-8-19)37-30(36)34-22-12-9-20(10-13-22)29-25(17-32)24-14-11-21(28-26(31)6-3-15-33-28)16-27(24)35(29)23-4-2-5-23;30-14-15-37-23-12-13-24-25(17-34)28(36(27(24)16-23)22-5-3-6-22)19-8-10-21(11-9-19)35-18-20-4-1-2-7-26(20)29(31,32)33;1-3-14-36(34,35)32-23-9-7-22(8-10-23)28-25(17-29)24-11-6-21(16-27-30-13-12-19(2)31-27)15-26(24)33(28)18-20-4-5-20;1-19(2)34-28(33)30-21-11-9-20(10-12-21)27-25(18-29)24-14-13-23(31-15-4-3-5-16-31)17-26(24)32(27)22-7-6-8-22;1-2-15-35(33,34)31-20-11-8-18(9-12-20)27-23(17-29)22-13-10-19(26-24(28)7-4-14-30-26)16-25(22)32(27)21-5-3-6-21;1-2-16-35(32,33)30-20-11-9-19(10-12-20)27-24(18-28)23-17-22(34-26-8-3-4-15-29-26)13-14-25(23)31(27)21-6-5-7-21;1-19(2)34(32,33)29-21-11-9-20(10-12-21)27-25(18-28)24-14-13-23(30-15-4-3-5-16-30)17-26(24)31(27)22-7-6-8-22;1-18(2)33(31,32)28-20-10-8-19(9-11-20)26-24(17-27)23-13-12-22(29-14-3-4-15-29)16-25(23)30(26)21-6-5-7-21;1-2-33(31,32)28-20-11-9-19(10-12-20)26-24(18-27)23-14-13-22(29-15-4-3-5-16-29)17-25(23)30(26)21-7-6-8-21;1-26(2,3)34-25(30)28-18-10-8-17(9-11-18)24-22(15-27)21-13-12-20(33-16-35(4,31)32)14-23(21)29(24)19-6-5-7-19/h3,6,9-16,18-19,23H,2,4-5,7-8H2,1H3,(H,34,36);1-2,4,7-13,16,22,35H,3,5-6,14-15,18H2;6-13,15,20,32H,3-5,14,16,18H2,1-2H3;9-14,17,19,22H,3-8,15-16H2,1-2H3,(H,30,33);4,7-14,16,21,31H,2-3,5-6,15H2,1H3;3-4,8-15,17,21,30H,2,5-7,16H2,1H3;9-14,17,19,22,29H,3-8,15-16H2,1-2H3;8-13,16,18,21,28H,3-7,14-15H2,1-2H3;9-14,17,21,28H,2-8,15-16H2,1H3;8-14,19H,5-7,16H2,1-4H3,(H,28,30)/t18-;;;;;;;;;/m1........./s1
InChIKeyALOBIMBJTQFSJD-RJYOUJLLSA-N
XLogP64.14
TPSA830.48 Ų
H-Bond Donors10
H-Bond Acceptors53
Rotatable Bonds67
Heavy Atoms349
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004863.91
LogP ≤ 564.14
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1053

Analyze tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate with MolForge

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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate?
The IUPAC name of tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate (CID 157153677) is tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate.
What is the SMILES notation for tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate?
The canonical SMILES for tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate is CC(C)(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(OCS(C)(=O)=O)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(C#N)c3ccc(N4CCCCC4)cc3n2C2CCC2)cc1.CC(C)S(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(N4CCCC4)cc3n2C2CCC2)cc1.CC(C)S(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(N4CCCCC4)cc3n2C2CCC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3cc(Oc4ccccn4)ccc3n2C2CCC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ncccc4Cl)cc3n2C2CCC2)cc1.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(Cc4nccc(C)n4)cc3n2CC2CC2)cc1.CCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(N4CCCCC4)cc3n2C2CCC2)cc1.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3ccc(-c4ncccc4Cl)cc3n2C2CCC2)cc1)C1CC1.N#Cc1c(-c2ccc(NCc3ccccc3C(F)(F)F)cc2)n(C2CCC2)c2cc(OCCF)ccc12.
What is the InChIKey of tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate?
The InChIKey is ALOBIMBJTQFSJD-RJYOUJLLSA-N. The full InChI is InChI=1S/C30H27ClN4O2.C29H25F4N3O.C28H29N5O2S.C28H32N4O2.C27H25ClN4O2S.C27H26N4O3S.C27H32N4O2S.2C26H30N4O2S.C26H29N3O5S/c1-18(19-7-8-19)37-30(36)34-22-12-9-20(10-13-22)29-25(17-32)24-14-11-21(28-26(31)6-3-15-33-28)16-27(24)35(29)23-4-2-5-23;30-14-15-37-23-12-13-24-25(17-34)28(36(27(24)16-23)22-5-3-6-22)19-8-10-21(11-9-19)35-18-20-4-1-2-7-26(20)29(31,32)33;1-3-14-36(34,35)32-23-9-7-22(8-10-23)28-25(17-29)24-11-6-21(16-27-30-13-12-19(2)31-27)15-26(24)33(28)18-20-4-5-20;1-19(2)34-28(33)30-21-11-9-20(10-12-21)27-25(18-29)24-14-13-23(31-15-4-3-5-16-31)17-26(24)32(27)22-7-6-8-22;1-2-15-35(33,34)31-20-11-8-18(9-12-20)27-23(17-29)22-13-10-19(26-24(28)7-4-14-30-26)16-25(22)32(27)21-5-3-6-21;1-2-16-35(32,33)30-20-11-9-19(10-12-20)27-24(18-28)23-17-22(34-26-8-3-4-15-29-26)13-14-25(23)31(27)21-6-5-7-21;1-19(2)34(32,33)29-21-11-9-20(10-12-21)27-25(18-28)24-14-13-23(30-15-4-3-5-16-30)17-26(24)31(27)22-7-6-8-22;1-18(2)33(31,32)28-20-10-8-19(9-11-20)26-24(17-27)23-13-12-22(29-14-3-4-15-29)16-25(23)30(26)21-6-5-7-21;1-2-33(31,32)28-20-11-9-19(10-12-20)26-24(18-27)23-14-13-22(29-15-4-3-5-16-29)17-25(23)30(26)21-7-6-8-21;1-26(2,3)34-25(30)28-18-10-8-17(9-11-18)24-22(15-27)21-13-12-20(33-16-35(4,31)32)14-23(21)29(24)19-6-5-7-19/h3,6,9-16,18-19,23H,2,4-5,7-8H2,1H3,(H,34,36);1-2,4,7-13,16,22,35H,3,5-6,14-15,18H2;6-13,15,20,32H,3-5,14,16,18H2,1-2H3;9-14,17,19,22H,3-8,15-16H2,1-2H3,(H,30,33);4,7-14,16,21,31H,2-3,5-6,15H2,1H3;3-4,8-15,17,21,30H,2,5-7,16H2,1H3;9-14,17,19,22,29H,3-8,15-16H2,1-2H3;8-13,16,18,21,28H,3-7,14-15H2,1-2H3;9-14,17,21,28H,2-8,15-16H2,1H3;8-14,19H,5-7,16H2,1-4H3,(H,28,30)/t18-;;;;;;;;;/m1........./s1.
What are the key properties of tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate?
tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate has a molecular weight of 4863.91 g/mol, XLogP of 64.14, 67 rotatable bonds, 10 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[4-[3-cyano-1-cyclobutyl-6-(methylsulfonylmethoxy)indol-2-yl]phenyl]carbamate;N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]ethanesulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-5-pyridin-2-yloxyindol-2-yl)phenyl]propane-1-sulfonamide;N-[4-(3-cyano-1-cyclobutyl-6-pyrrolidin-1-ylindol-2-yl)phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(4-methylpyrimidin-2-yl)methyl]indol-2-yl]phenyl]propane-1-sulfonamide;1-cyclobutyl-6-(2-fluoroethoxy)-2-[4-[[2-(trifluoromethyl)phenyl]methylamino]phenyl]indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[6-(3-chloro-2-pyridinyl)-3-cyano-1-cyclobutylindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-piperidin-1-ylindol-2-yl)phenyl]carbamate is sourced from PubChem (CID 157153677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).