methyl 2-[[4-(dimethylamino)-4-thiophen-2-yl-cyclohexyl]amino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-[[4-(dimethylamino)-4-thiophen-2-yl-cyclohexyl]amino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-[[4-(dimethylamino)-4-(2-thienyl)cyclohexyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[4-(dimethylamino)-4-thiophen-2-ylcyclohexyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[[4-(dimethylamino)-4-thiophen-2-ylcyclohexyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[[4-(dimethylamino)-4-(2-thienyl)cyclohexyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C24H31N3O2S MolecularWeight: 425.58684

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1(CCC(CC1)NC(CC2=CNC3=CC=CC=C32)C(=O)OC)C4=CC=CS4

Isomeric SMILES

CN(C)C1(CCC(CC1)NC(CC2=CNC3=CC=CC=C32)C(=O)OC)C4=CC=CS4

InChI

InChI=1S/C24H31N3O2S/c1-27(2)24(22-9-6-14-30-22)12-10-18(11-13-24)26-21(23(28)29-3)15-17-16-25-20-8-5-4-7-19(17)20/h4-9,14,16,18,21,25-26H,10-13,15H2,1-3H3