1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate

C181H200N26O22 — CID 158321504

IUPAC1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate
SMILESCC(C)OC(=O)Nc1ccc(-c2c(-c3ccn(C)n3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3ccn[nH]3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4nccn4C)cc3n2C2CC2)cc1)C1CC1.Cc1cn(C)nc1-c1c(-c2ccc(NC(=O)OC(C)C)cc2)n(C2CCC2)c2cc(OC3CCOCC3)ccc12.Cc1cn[nH]c1-c1c(-c2ccc(NC(=O)OC(C)C)cc2)n(C2CCC2)c2cc(OC3CCOCC3)ccc12.Cc1cnc(Oc2ccc3c(C#N)c(-c4ccc(NC(=O)OC(C)C5CC5)cc4)n(C4CC4)c3c2)n1C
InChIInChI=1S/C32H38N4O4.2C31H36N4O4.C30H34N4O4.C29H29N5O3.C28H27N5O3/c1-20(2)39-32(37)33-23-10-8-22(9-11-23)31-29(30-21(3)19-35(4)34-30)27-13-12-26(40-25-14-16-38-17-15-25)18-28(27)36(31)24-6-5-7-24;1-20(2)38-31(36)32-22-9-7-21(8-10-22)30-29(27-13-16-34(3)33-27)26-12-11-25(39-24-14-17-37-18-15-24)19-28(26)35(30)23-5-4-6-23;1-19(2)38-31(36)33-22-9-7-21(8-10-22)30-28(29-20(3)18-32-34-29)26-12-11-25(39-24-13-15-37-16-14-24)17-27(26)35(30)23-5-4-6-23;1-19(2)37-30(35)32-21-8-6-20(7-9-21)29-28(26-12-15-31-33-26)25-11-10-24(38-23-13-16-36-17-14-23)18-27(25)34(29)22-4-3-5-22;1-17-16-31-28(33(17)3)37-23-12-13-24-25(15-30)27(34(22-10-11-22)26(24)14-23)20-6-8-21(9-7-20)32-29(35)36-18(2)19-4-5-19;1-17(18-3-4-18)35-28(34)31-20-7-5-19(6-8-20)26-24(16-29)23-12-11-22(36-27-30-13-14-32(27)2)15-25(23)33(26)21-9-10-21/h8-13,18-20,24-25H,5-7,14-17H2,1-4H3,(H,33,37);7-13,16,19-20,23-24H,4-6,14-15,17-18H2,1-3H3,(H,32,36);7-12,17-19,23-24H,4-6,13-16H2,1-3H3,(H,32,34)(H,33,36);6-12,15,18-19,22-23H,3-5,13-14,16-17H2,1-2H3,(H,31,33)(H,32,35);6-9,12-14,16,18-19,22H,4-5,10-11H2,1-3H3,(H,32,35);5-8,11-15,17-18,21H,3-4,9-10H2,1-2H3,(H,31,34)
InChIKeyGOXFUMGBJPDYBA-UHFFFAOYSA-N
MW3091.75 g/mol
LogP41.47
Rot. Bonds42

About 1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate

1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate (PubChem CID 158321504) has the molecular formula C181H200N26O22 and a molecular weight of 3091.75 g/mol. Its IUPAC name is 1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate.

Molecular Properties

Compound Name1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate
PubChem CID158321504
Molecular FormulaC181H200N26O22
Molecular Weight3091.75 g/mol
Exact Mass3089.53
IUPAC Name1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate
SMILESCC(C)OC(=O)Nc1ccc(-c2c(-c3ccn(C)n3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3ccn[nH]3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4nccn4C)cc3n2C2CC2)cc1)C1CC1.Cc1cn(C)nc1-c1c(-c2ccc(NC(=O)OC(C)C)cc2)n(C2CCC2)c2cc(OC3CCOCC3)ccc12.Cc1cn[nH]c1-c1c(-c2ccc(NC(=O)OC(C)C)cc2)n(C2CCC2)c2cc(OC3CCOCC3)ccc12.Cc1cnc(Oc2ccc3c(C#N)c(-c4ccc(NC(=O)OC(C)C5CC5)cc4)n(C4CC4)c3c2)n1C
InChIInChI=1S/C32H38N4O4.2C31H36N4O4.C30H34N4O4.C29H29N5O3.C28H27N5O3/c1-20(2)39-32(37)33-23-10-8-22(9-11-23)31-29(30-21(3)19-35(4)34-30)27-13-12-26(40-25-14-16-38-17-15-25)18-28(27)36(31)24-6-5-7-24;1-20(2)38-31(36)32-22-9-7-21(8-10-22)30-29(27-13-16-34(3)33-27)26-12-11-25(39-24-14-17-37-18-15-24)19-28(26)35(30)23-5-4-6-23;1-19(2)38-31(36)33-22-9-7-21(8-10-22)30-28(29-20(3)18-32-34-29)26-12-11-25(39-24-13-15-37-16-14-24)17-27(26)35(30)23-5-4-6-23;1-19(2)37-30(35)32-21-8-6-20(7-9-21)29-28(26-12-15-31-33-26)25-11-10-24(38-23-13-16-36-17-14-23)18-27(25)34(29)22-4-3-5-22;1-17-16-31-28(33(17)3)37-23-12-13-24-25(15-30)27(34(22-10-11-22)26(24)14-23)20-6-8-21(9-7-20)32-29(35)36-18(2)19-4-5-19;1-17(18-3-4-18)35-28(34)31-20-7-5-19(6-8-20)26-24(16-29)23-12-11-22(36-27-30-13-14-32(27)2)15-25(23)33(26)21-9-10-21/h8-13,18-20,24-25H,5-7,14-17H2,1-4H3,(H,33,37);7-13,16,19-20,23-24H,4-6,14-15,17-18H2,1-3H3,(H,32,36);7-12,17-19,23-24H,4-6,13-16H2,1-3H3,(H,32,34)(H,33,36);6-12,15,18-19,22-23H,3-5,13-14,16-17H2,1-2H3,(H,31,33)(H,32,35);6-9,12-14,16,18-19,22H,4-5,10-11H2,1-3H3,(H,32,35);5-8,11-15,17-18,21H,3-4,9-10H2,1-2H3,(H,31,34)
InChIKeyGOXFUMGBJPDYBA-UHFFFAOYSA-N
XLogP41.47
TPSA528.08 Ų
H-Bond Donors8
H-Bond Acceptors40
Rotatable Bonds42
Heavy Atoms229
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003091.75
LogP ≤ 541.47
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1040

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Analyze 1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate with MolForge

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Related Compounds

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
CID 157974736
CID 157974736
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
CID 158544701
CID 158544701
[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(2-fluoroethoxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclobutyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-(1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[2-chloro-4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;propan-2-yl N-[4-(3-cyano-1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)-2-fluorophenyl]carbamate
CID 159525800
N-[4-[3-cyano-1-cyclobutyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]-1-ethylcyclopropane-1-sulfonamide;N-[4-[3-cyano-1-cyclobutyl-6-(2,2,2-trifluoroethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-cyclopropyl-6-(difluoromethoxy)indol-2-yl]phenyl]propane-2-sulfonamide;N-[4-[3-cyano-1-(cyclopropylmethyl)-6-pyrimidin-2-yloxyindol-2-yl]phenyl]propane-1-sulfonamide;[(1R)-1-cyclopropylethyl] N-[4-(3-cyano-1-cyclobutyl-6-pyrazin-2-yloxyindol-2-yl)phenyl]carbamate
CID 159903105
CID 160124863
CID 160124863
(3S)-N-[4-(1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]-4,4,4-trifluoro-3-methylbutanamide;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-(cyclopropylmethyl)-6-piperidin-1-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclopropyl-6-(3-methylpyrazin-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-piperidin-1-ylindol-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;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-(3-cyano-1-propan-2-yl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate
CID 160224327
[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-(cyclopropylmethyl)-6-piperidin-1-ylindol-2-yl]phenyl]carbamate;[(1R)-1-cyclopropylethyl] N-[4-[3-cyano-1-cyclopropyl-6-(3-methylpyrazin-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[3-cyano-1-(cyclopropylmethyl)-6-piperidin-1-ylindol-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;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-(3-cyano-1-propan-2-yl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate;[(2R)-1,1,1-trifluoropropan-2-yl] N-[4-(1-cyclobutyl-6-pyrimidin-2-yloxyindol-2-yl)phenyl]carbamate
CID 160242221
CID 160248318
CID 160248318

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate?
The IUPAC name of 1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate (CID 158321504) is 1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate.
What is the SMILES notation for 1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate?
The canonical SMILES for 1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate is CC(C)OC(=O)Nc1ccc(-c2c(-c3ccn(C)n3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(C)OC(=O)Nc1ccc(-c2c(-c3ccn[nH]3)c3ccc(OC4CCOCC4)cc3n2C2CCC2)cc1.CC(OC(=O)Nc1ccc(-c2c(C#N)c3ccc(Oc4nccn4C)cc3n2C2CC2)cc1)C1CC1.Cc1cn(C)nc1-c1c(-c2ccc(NC(=O)OC(C)C)cc2)n(C2CCC2)c2cc(OC3CCOCC3)ccc12.Cc1cn[nH]c1-c1c(-c2ccc(NC(=O)OC(C)C)cc2)n(C2CCC2)c2cc(OC3CCOCC3)ccc12.Cc1cnc(Oc2ccc3c(C#N)c(-c4ccc(NC(=O)OC(C)C5CC5)cc4)n(C4CC4)c3c2)n1C.
What is the InChIKey of 1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate?
The InChIKey is GOXFUMGBJPDYBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H38N4O4.2C31H36N4O4.C30H34N4O4.C29H29N5O3.C28H27N5O3/c1-20(2)39-32(37)33-23-10-8-22(9-11-23)31-29(30-21(3)19-35(4)34-30)27-13-12-26(40-25-14-16-38-17-15-25)18-28(27)36(31)24-6-5-7-24;1-20(2)38-31(36)32-22-9-7-21(8-10-22)30-29(27-13-16-34(3)33-27)26-12-11-25(39-24-14-17-37-18-15-24)19-28(26)35(30)23-5-4-6-23;1-19(2)38-31(36)33-22-9-7-21(8-10-22)30-28(29-20(3)18-32-34-29)26-12-11-25(39-24-13-15-37-16-14-24)17-27(26)35(30)23-5-4-6-23;1-19(2)37-30(35)32-21-8-6-20(7-9-21)29-28(26-12-15-31-33-26)25-11-10-24(38-23-13-16-36-17-14-23)18-27(25)34(29)22-4-3-5-22;1-17-16-31-28(33(17)3)37-23-12-13-24-25(15-30)27(34(22-10-11-22)26(24)14-23)20-6-8-21(9-7-20)32-29(35)36-18(2)19-4-5-19;1-17(18-3-4-18)35-28(34)31-20-7-5-19(6-8-20)26-24(16-29)23-12-11-22(36-27-30-13-14-32(27)2)15-25(23)33(26)21-9-10-21/h8-13,18-20,24-25H,5-7,14-17H2,1-4H3,(H,33,37);7-13,16,19-20,23-24H,4-6,14-15,17-18H2,1-3H3,(H,32,36);7-12,17-19,23-24H,4-6,13-16H2,1-3H3,(H,32,34)(H,33,36);6-12,15,18-19,22-23H,3-5,13-14,16-17H2,1-2H3,(H,31,33)(H,32,35);6-9,12-14,16,18-19,22H,4-5,10-11H2,1-3H3,(H,32,35);5-8,11-15,17-18,21H,3-4,9-10H2,1-2H3,(H,31,34).
What are the key properties of 1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate?
1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate has a molecular weight of 3091.75 g/mol, XLogP of 41.47, 42 rotatable bonds, 8 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1,5-dimethylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;1-cyclopropylethyl N-[4-[3-cyano-1-cyclopropyl-6-(1-methylimidazol-2-yl)oxyindol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1,4-dimethylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(1-methylpyrazol-3-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-3-(4-methyl-1H-pyrazol-5-yl)-6-(oxan-4-yloxy)indol-2-yl]phenyl]carbamate;propan-2-yl N-[4-[1-cyclobutyl-6-(oxan-4-yloxy)-3-(1H-pyrazol-5-yl)indol-2-yl]phenyl]carbamate is sourced from PubChem (CID 158321504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).