N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate

C336H364F3N44O50PS2 — CID 159076240

IUPACN-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate
SMILESCC(C)n1c(-c2ccc(NC(=O)O[C@H](C)C3CC3)cc2)c(C#N)c2ccc(OC3CCOCC3)cc21.CC(C)n1c(-c2ccc(NC(=O)O[C@H](C)C3CC3)cc2)c(C#N)c2ccc(O[C@@H]3CCOC3)cc21.CC(C)n1c(-c2ccc(NC(=O)O[C@H](C)C3CC3)cc2)c(C#N)c2ccc(O[C@H]3CCOC3)cc21.CC(OC(=O)Nc1ccc(-c2c(C#N)c3cc(OC4COCOC4)ccc3n2C2CCC2)cc1)C(C)(C)C.CC(OC(=O)Nc1ccc(-c2c(C#N)c3cc(OC4COCOC4)ccc3n2C2CCC2)cc1)C(F)(F)F.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CCOP(=O)(Nc1ccc(-c2c(C#N)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1)OCC.CCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CNC(=O)Nc1ccc(-c2c(C#N)c3cc(OCCCn4cncn4)ccc3n2C2CCC2)cc1.COc1ccnc(Oc2ccc3c(C#N)c(-c4ccc(NC(=O)OC(C)C)cc4)n(C4CCC4)c3c2)n1.COc1ccnc(Oc2ccc3c(C#N)c(-c4ccc(NC(=O)O[C@H](C)C5CC5)cc4)n(C4CCC4)c3c2)n1.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3cc(OC4COCOC4)ccc3n2C2CCC2)cc1)C1CC1
InChIInChI=1S/C30H29N5O4.C30H35N3O5.C29H31N3O5.C29H33N3O4.C28H27N5O4.C28H34N3O5P.2C28H31N3O4.C27H26F3N3O5.C27H31N3O4S.C26H27N7O2.C26H29N3O4S/c1-18(19-6-7-19)38-30(36)33-21-10-8-20(9-11-21)28-25(17-31)24-13-12-23(16-26(24)35(28)22-4-3-5-22)39-29-32-15-14-27(34-29)37-2;1-19(30(2,3)4)37-29(34)32-21-10-8-20(9-11-21)28-26(15-31)25-14-23(38-24-16-35-18-36-17-24)12-13-27(25)33(28)22-6-5-7-22;1-18(19-5-6-19)36-29(33)31-21-9-7-20(8-10-21)28-26(14-30)25-13-23(37-24-15-34-17-35-16-24)11-12-27(25)32(28)22-3-2-4-22;1-18(2)32-27-16-24(36-23-12-14-34-15-13-23)10-11-25(27)26(17-30)28(32)21-6-8-22(9-7-21)31-29(33)35-19(3)20-4-5-20;1-17(2)36-28(34)31-19-9-7-18(8-10-19)26-23(16-29)22-12-11-21(15-24(22)33(26)20-5-4-6-20)37-27-30-14-13-25(32-27)35-3;1-3-34-37(32,35-4-2)30-21-10-8-20(9-11-21)28-26(19-29)25-13-12-24(36-23-14-16-33-17-15-23)18-27(25)31(28)22-6-5-7-22;2*1-17(2)31-26-14-22(35-23-12-13-33-16-23)10-11-24(26)25(15-29)27(31)20-6-8-21(9-7-20)30-28(32)34-18(3)19-4-5-19;1-16(27(28,29)30)37-26(34)32-18-7-5-17(6-8-18)25-23(12-31)22-11-20(38-21-13-35-15-36-14-21)9-10-24(22)33(25)19-3-2-4-19;1-2-16-35(31,32)29-20-8-6-19(7-9-20)27-25(18-28)24-11-10-23(34-22-12-14-33-15-13-22)17-26(24)30(27)21-4-3-5-21;1-28-26(34)31-19-8-6-18(7-9-19)25-23(15-27)22-14-21(35-13-3-12-32-17-29-16-30-32)10-11-24(22)33(25)20-4-2-5-20;1-2-34(30,31)28-19-8-6-18(7-9-19)26-24(17-27)23-11-10-22(33-21-12-14-32-15-13-21)16-25(23)29(26)20-4-3-5-20/h8-16,18-19,22H,3-7H2,1-2H3,(H,33,36);8-14,19,22,24H,5-7,16-18H2,1-4H3,(H,32,34);7-13,18-19,22,24H,2-6,15-17H2,1H3,(H,31,33);6-11,16,18-20,23H,4-5,12-15H2,1-3H3,(H,31,33);7-15,17,20H,4-6H2,1-3H3,(H,31,34);8-13,18,22-23H,3-7,14-17H2,1-2H3,(H,30,32);2*6-11,14,17-19,23H,4-5,12-13,16H2,1-3H3,(H,30,32);5-11,16,19,21H,2-4,13-15H2,1H3,(H,32,34);6-11,17,21-22,29H,2-5,12-16H2,1H3;6-11,14,16-17,20H,2-5,12-13H2,1H3,(H2,28,31,34);6-11,16,20-21,28H,2-5,12-15H2,1H3/t18-;;18-;19-;;;18-,23+;18-,23-;;;;/m1.11..11..../s1
InChIKeyKAHBLPWKOKPDDW-ICOLMAMGSA-N
MW5970.97 g/mol
LogP73.92
Rot. Bonds88

About N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate

N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate (PubChem CID 159076240) has the molecular formula C336H364F3N44O50PS2 and a molecular weight of 5970.97 g/mol. Its IUPAC name is N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate.

Molecular Properties

Compound NameN-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate
PubChem CID159076240
Molecular FormulaC336H364F3N44O50PS2
Molecular Weight5970.97 g/mol
Exact Mass5966.64
IUPAC NameN-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate
SMILESCC(C)n1c(-c2ccc(NC(=O)O[C@H](C)C3CC3)cc2)c(C#N)c2ccc(OC3CCOCC3)cc21.CC(C)n1c(-c2ccc(NC(=O)O[C@H](C)C3CC3)cc2)c(C#N)c2ccc(O[C@@H]3CCOC3)cc21.CC(C)n1c(-c2ccc(NC(=O)O[C@H](C)C3CC3)cc2)c(C#N)c2ccc(O[C@H]3CCOC3)cc21.CC(OC(=O)Nc1ccc(-c2c(C#N)c3cc(OC4COCOC4)ccc3n2C2CCC2)cc1)C(C)(C)C.CC(OC(=O)Nc1ccc(-c2c(C#N)c3cc(OC4COCOC4)ccc3n2C2CCC2)cc1)C(F)(F)F.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CCOP(=O)(Nc1ccc(-c2c(C#N)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1)OCC.CCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CNC(=O)Nc1ccc(-c2c(C#N)c3cc(OCCCn4cncn4)ccc3n2C2CCC2)cc1.COc1ccnc(Oc2ccc3c(C#N)c(-c4ccc(NC(=O)OC(C)C)cc4)n(C4CCC4)c3c2)n1.COc1ccnc(Oc2ccc3c(C#N)c(-c4ccc(NC(=O)O[C@H](C)C5CC5)cc4)n(C4CCC4)c3c2)n1.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3cc(OC4COCOC4)ccc3n2C2CCC2)cc1)C1CC1
InChIInChI=1S/C30H29N5O4.C30H35N3O5.C29H31N3O5.C29H33N3O4.C28H27N5O4.C28H34N3O5P.2C28H31N3O4.C27H26F3N3O5.C27H31N3O4S.C26H27N7O2.C26H29N3O4S/c1-18(19-6-7-19)38-30(36)33-21-10-8-20(9-11-21)28-25(17-31)24-13-12-23(16-26(24)35(28)22-4-3-5-22)39-29-32-15-14-27(34-29)37-2;1-19(30(2,3)4)37-29(34)32-21-10-8-20(9-11-21)28-26(15-31)25-14-23(38-24-16-35-18-36-17-24)12-13-27(25)33(28)22-6-5-7-22;1-18(19-5-6-19)36-29(33)31-21-9-7-20(8-10-21)28-26(14-30)25-13-23(37-24-15-34-17-35-16-24)11-12-27(25)32(28)22-3-2-4-22;1-18(2)32-27-16-24(36-23-12-14-34-15-13-23)10-11-25(27)26(17-30)28(32)21-6-8-22(9-7-21)31-29(33)35-19(3)20-4-5-20;1-17(2)36-28(34)31-19-9-7-18(8-10-19)26-23(16-29)22-12-11-21(15-24(22)33(26)20-5-4-6-20)37-27-30-14-13-25(32-27)35-3;1-3-34-37(32,35-4-2)30-21-10-8-20(9-11-21)28-26(19-29)25-13-12-24(36-23-14-16-33-17-15-23)18-27(25)31(28)22-6-5-7-22;2*1-17(2)31-26-14-22(35-23-12-13-33-16-23)10-11-24(26)25(15-29)27(31)20-6-8-21(9-7-20)30-28(32)34-18(3)19-4-5-19;1-16(27(28,29)30)37-26(34)32-18-7-5-17(6-8-18)25-23(12-31)22-11-20(38-21-13-35-15-36-14-21)9-10-24(22)33(25)19-3-2-4-19;1-2-16-35(31,32)29-20-8-6-19(7-9-20)27-25(18-28)24-11-10-23(34-22-12-14-33-15-13-22)17-26(24)30(27)21-4-3-5-21;1-28-26(34)31-19-8-6-18(7-9-19)25-23(15-27)22-14-21(35-13-3-12-32-17-29-16-30-32)10-11-24(22)33(25)20-4-2-5-20;1-2-34(30,31)28-19-8-6-18(7-9-19)26-24(17-27)23-11-10-22(33-21-12-14-32-15-13-21)16-25(23)29(26)20-4-3-5-20/h8-16,18-19,22H,3-7H2,1-2H3,(H,33,36);8-14,19,22,24H,5-7,16-18H2,1-4H3,(H,32,34);7-13,18-19,22,24H,2-6,15-17H2,1H3,(H,31,33);6-11,16,18-20,23H,4-5,12-15H2,1-3H3,(H,31,33);7-15,17,20H,4-6H2,1-3H3,(H,31,34);8-13,18,22-23H,3-7,14-17H2,1-2H3,(H,30,32);2*6-11,14,17-19,23H,4-5,12-13,16H2,1-3H3,(H,30,32);5-11,16,19,21H,2-4,13-15H2,1H3,(H,32,34);6-11,17,21-22,29H,2-5,12-16H2,1H3;6-11,14,16-17,20H,2-5,12-13H2,1H3,(H2,28,31,34);6-11,16,20-21,28H,2-5,12-15H2,1H3/t18-;;18-;19-;;;18-,23+;18-,23-;;;;/m1.11..11..../s1
InChIKeyKAHBLPWKOKPDDW-ICOLMAMGSA-N
XLogP73.92
TPSA1154.56 Ų
H-Bond Donors13
H-Bond Acceptors81
Rotatable Bonds88
Heavy Atoms436
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005970.97
LogP ≤ 573.92
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1081

Analyze N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate with MolForge

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Related Compounds

1-[2-cyano-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]-3-propan-2-ylurea;1-cyclobutyl-2-[2-(propan-2-ylamino)pyrimidin-5-yl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[2-cyano-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;2-[4-[1-(cyclopropylmethyl)-6-pyrimidin-2-yloxyindol-2-yl]phenyl]-1,2-thiazolidine 1,1-dioxide;propan-2-yl N-[2-cyano-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[5-[1-(azetidin-1-yl)-3-cyano-6-pyrimidin-2-yloxy-1H-inden-2-yl]-2-pyridinyl]carbamate
CID 157159756
N-[4-[3-cyano-1-cyclobutyl-6-[(2S)-2,3-dihydroxypropoxy]indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-6-(2-fluoroethoxy)indol-2-yl]-2,6-difluorophenyl]-3-propan-2-ylurea;1-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,6-difluorophenyl]-3-propan-2-ylurea;N-[4-[3-cyano-1-cyclopropyl-6-[[3-(trifluoromethyl)-2-pyridinyl]oxy]indol-2-yl]-3-methylphenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-[(2S)-2,3-dihydroxypropoxy]indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(2-fluoroethoxy)indol-2-yl]-2,6-difluorophenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(2-fluoroethoxy)indol-2-yl]-2,6-difluorophenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(2,2-difluoroethoxy)indol-2-yl]phenyl]carbamate
CID 157180987
1-cyclobutyl-2-[4-(ethylsulfamoylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;1-cyclobutyl-2-[4-(methylsulfamoylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[1-(cyclopropylmethyl)-6-ethoxy-3-fluoroindol-2-yl]phenyl]carbamate;[(1R)-1-(4-fluorophenyl)ethyl] N-[4-(3-cyano-1-cyclobutyl-5-morpholin-4-ylindol-2-yl)phenyl]carbamate;[(1R)-1-(4-fluorophenyl)ethyl] N-[4-[3-cyano-1-cyclobutyl-6-[4-(1,2,4-triazol-1-yl)butoxy]indol-2-yl]phenyl]carbamate;[(1R)-1-(4-fluorophenyl)ethyl] N-[4-[3-cyano-1-cyclopropyl-6-(2-imidazol-1-ylethoxy)indol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-(3-cyano-1-cyclobutyl-5-morpholin-4-ylindol-2-yl)phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-[4-(1,2,4-triazol-1-yl)butoxy]indol-2-yl]phenyl]carbamate
CID 157267853
N-[4-[3-cyano-1-(cyclopropylmethyl)-6-[(3-fluoro-2-pyridinyl)oxy]indol-2-yl]-3-methylphenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,6-difluorophenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-(trifluoromethoxy)phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-(cyclopropylmethyl)-6-(4-methylpyrimidin-2-yl)oxyindol-2-yl]-3-methylphenyl]carbamate;1-(cyclopropylmethyl)-6-(2-methylsulfonylethoxy)-2-[4-(propan-2-ylamino)phenyl]indole-3-carbonitrile;1-(cyclopropylmethyl)-6-(3-methylsulfonylpropoxy)-2-[4-(propan-2-ylamino)phenyl]indole-3-carbonitrile;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2,6-difluorophenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-(trifluoromethoxy)phenyl]carbamate
CID 157344993
CID 157834402
CID 157834402
CID 157892881
CID 157892881
CID 157974736
CID 157974736
N-[4-[3-cyano-6-(3-cyanopyrazin-2-yl)oxy-1-(cyclopropylmethyl)indol-2-yl]phenyl]cyclobutanesulfonamide;N-[4-[3-cyano-6-[(3-cyano-2-pyridinyl)oxy]-1-cyclobutylindol-2-yl]-2-methylphenyl]-2-methylpropane-1-sulfonamide;N-[4-[3-cyano-6-[(3-cyano-2-pyridinyl)oxy]-1-cyclobutylindol-2-yl]-2-methylphenyl]propane-1-sulfonamide;1-cyclobutyl-5-(2,2-difluoroethoxy)-2-[4-(2,2-difluoroethylamino)phenyl]indole-3-carbonitrile;1-cyclobutyl-2-[4-[(1,1-dioxothian-4-yl)amino]phenyl]-6-pyrimidin-2-yloxyindole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(2-fluoroethoxy)indol-2-yl]-2-(trifluoromethyl)phenyl]carbamate
CID 158050207
1-[4-[3-cyano-1-cyclobutyl-6-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]-3-propan-2-ylurea;1-[4-[3-cyano-1-(cyclopropylmethyl)-6-morpholin-4-ylindol-2-yl]phenyl]-3-cyclobutylurea;N-[4-(3-cyano-1-cyclopropyl-6-morpholin-4-ylindol-2-yl)phenyl]cyclopropanesulfonamide;1-cyclopropyl-6-(oxan-4-yloxy)-2-[4-(propan-2-ylsulfamoylamino)phenyl]indole-3-carbonitrile;[(1R)-1-(4-fluorophenyl)ethyl] N-[4-[3-cyano-1-cyclobutyl-6-(1,3-dioxolan-4-ylmethoxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-[(1-ethylimidazol-2-yl)methoxy]indol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(difluoromethoxy)indol-2-yl]phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-(3-cyano-1-cyclobutyl-6-ethoxyindol-2-yl)phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-[3-cyano-1-cyclobutyl-6-(2-fluoroethoxy)indol-2-yl]phenyl]carbamate
CID 158131561
1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-propan-2-ylurea;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1S)-1-phenylethyl] N-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]carbamate;[(1R)-1-phenylethyl] N-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate
CID 158338953
1-[4-[1-(cyclopropylmethyl)-6-ethoxy-3-fluoroindol-2-yl]phenyl]-3-propan-2-ylurea;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-(4-imidazol-1-ylbutoxy)indol-2-yl]phenyl]carbamate;1-(4-fluorophenyl)ethyl N-[4-[3-cyano-1-cyclobutyl-6-[4-(1,2,4-triazol-1-yl)butoxy]indol-2-yl]phenyl]carbamate;(2,2,2-trifluoro-1-phenylethyl) N-[4-[3-cyano-1-cyclobutyl-6-[4-(1,2,4-triazol-1-yl)butoxy]indol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(1,3-dioxolan-2-ylmethoxy)indol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-[4-(1,2,4-triazol-1-yl)butoxy]indol-2-yl]phenyl]carbamate
CID 158378689
CID 158385604
CID 158385604

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate?
The IUPAC name of N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate (CID 159076240) is N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate.
What is the SMILES notation for N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate?
The canonical SMILES for N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate is CC(C)n1c(-c2ccc(NC(=O)O[C@H](C)C3CC3)cc2)c(C#N)c2ccc(OC3CCOCC3)cc21.CC(C)n1c(-c2ccc(NC(=O)O[C@H](C)C3CC3)cc2)c(C#N)c2ccc(O[C@@H]3CCOC3)cc21.CC(C)n1c(-c2ccc(NC(=O)O[C@H](C)C3CC3)cc2)c(C#N)c2ccc(O[C@H]3CCOC3)cc21.CC(OC(=O)Nc1ccc(-c2c(C#N)c3cc(OC4COCOC4)ccc3n2C2CCC2)cc1)C(C)(C)C.CC(OC(=O)Nc1ccc(-c2c(C#N)c3cc(OC4COCOC4)ccc3n2C2CCC2)cc1)C(F)(F)F.CCCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CCOP(=O)(Nc1ccc(-c2c(C#N)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1)OCC.CCS(=O)(=O)Nc1ccc(-c2c(C#N)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CNC(=O)Nc1ccc(-c2c(C#N)c3cc(OCCCn4cncn4)ccc3n2C2CCC2)cc1.COc1ccnc(Oc2ccc3c(C#N)c(-c4ccc(NC(=O)OC(C)C)cc4)n(C4CCC4)c3c2)n1.COc1ccnc(Oc2ccc3c(C#N)c(-c4ccc(NC(=O)O[C@H](C)C5CC5)cc4)n(C4CCC4)c3c2)n1.C[C@@H](OC(=O)Nc1ccc(-c2c(C#N)c3cc(OC4COCOC4)ccc3n2C2CCC2)cc1)C1CC1.
What is the InChIKey of N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate?
The InChIKey is KAHBLPWKOKPDDW-ICOLMAMGSA-N. The full InChI is InChI=1S/C30H29N5O4.C30H35N3O5.C29H31N3O5.C29H33N3O4.C28H27N5O4.C28H34N3O5P.2C28H31N3O4.C27H26F3N3O5.C27H31N3O4S.C26H27N7O2.C26H29N3O4S/c1-18(19-6-7-19)38-30(36)33-21-10-8-20(9-11-21)28-25(17-31)24-13-12-23(16-26(24)35(28)22-4-3-5-22)39-29-32-15-14-27(34-29)37-2;1-19(30(2,3)4)37-29(34)32-21-10-8-20(9-11-21)28-26(15-31)25-14-23(38-24-16-35-18-36-17-24)12-13-27(25)33(28)22-6-5-7-22;1-18(19-5-6-19)36-29(33)31-21-9-7-20(8-10-21)28-26(14-30)25-13-23(37-24-15-34-17-35-16-24)11-12-27(25)32(28)22-3-2-4-22;1-18(2)32-27-16-24(36-23-12-14-34-15-13-23)10-11-25(27)26(17-30)28(32)21-6-8-22(9-7-21)31-29(33)35-19(3)20-4-5-20;1-17(2)36-28(34)31-19-9-7-18(8-10-19)26-23(16-29)22-12-11-21(15-24(22)33(26)20-5-4-6-20)37-27-30-14-13-25(32-27)35-3;1-3-34-37(32,35-4-2)30-21-10-8-20(9-11-21)28-26(19-29)25-13-12-24(36-23-14-16-33-17-15-23)18-27(25)31(28)22-6-5-7-22;2*1-17(2)31-26-14-22(35-23-12-13-33-16-23)10-11-24(26)25(15-29)27(31)20-6-8-21(9-7-20)30-28(32)34-18(3)19-4-5-19;1-16(27(28,29)30)37-26(34)32-18-7-5-17(6-8-18)25-23(12-31)22-11-20(38-21-13-35-15-36-14-21)9-10-24(22)33(25)19-3-2-4-19;1-2-16-35(31,32)29-20-8-6-19(7-9-20)27-25(18-28)24-11-10-23(34-22-12-14-33-15-13-22)17-26(24)30(27)21-4-3-5-21;1-28-26(34)31-19-8-6-18(7-9-19)25-23(15-27)22-14-21(35-13-3-12-32-17-29-16-30-32)10-11-24(22)33(25)20-4-2-5-20;1-2-34(30,31)28-19-8-6-18(7-9-19)26-24(17-27)23-11-10-22(33-21-12-14-32-15-13-21)16-25(23)29(26)20-4-3-5-20/h8-16,18-19,22H,3-7H2,1-2H3,(H,33,36);8-14,19,22,24H,5-7,16-18H2,1-4H3,(H,32,34);7-13,18-19,22,24H,2-6,15-17H2,1H3,(H,31,33);6-11,16,18-20,23H,4-5,12-15H2,1-3H3,(H,31,33);7-15,17,20H,4-6H2,1-3H3,(H,31,34);8-13,18,22-23H,3-7,14-17H2,1-2H3,(H,30,32);2*6-11,14,17-19,23H,4-5,12-13,16H2,1-3H3,(H,30,32);5-11,16,19,21H,2-4,13-15H2,1H3,(H,32,34);6-11,17,21-22,29H,2-5,12-16H2,1H3;6-11,14,16-17,20H,2-5,12-13H2,1H3,(H2,28,31,34);6-11,16,20-21,28H,2-5,12-15H2,1H3/t18-;;18-;19-;;;18-,23+;18-,23-;;;;/m1.11..11..../s1.
What are the key properties of N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate?
N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate has a molecular weight of 5970.97 g/mol, XLogP of 73.92, 88 rotatable bonds, 13 hydrogen bond donors, and 81 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]ethanesulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(oxan-4-yloxy)indol-2-yl]phenyl]propane-1-sulfonamide;1-[4-[3-cyano-1-cyclobutyl-5-[3-(1,2,4-triazol-1-yl)propoxy]indol-2-yl]phenyl]-3-methylurea;1-cyclobutyl-2-[4-(diethoxyphosphorylamino)phenyl]-6-(oxan-4-yloxy)indole-3-carbonitrile;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-(oxan-4-yloxy)-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3R)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-6-[(3S)-oxolan-3-yl]oxy-1-propan-2-ylindol-2-yl]phenyl]carbamate;3,3-dimethylbutan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-cyclobutyl-6-(4-methoxypyrimidin-2-yl)oxyindol-2-yl]phenyl]carbamate;1,1,1-trifluoropropan-2-yl N-[4-[3-cyano-1-cyclobutyl-5-(1,3-dioxan-5-yloxy)indol-2-yl]phenyl]carbamate is sourced from PubChem (CID 159076240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).