4-(1,5-dimethyl-2-phenyl-indol-3-yl)carbonyl-N-(4-oxidanylcyclohexyl)-2-piperazin-1-yl-pyridine-3-carboxamide

Systemtic Name: 4-(1,5-dimethyl-2-phenyl-indol-3-yl)carbonyl-N-(4-oxidanylcyclohexyl)-2-piperazin-1-yl-pyridine-3-carboxamide Openeye Name: 4-(1,5-dimethyl-2-phenyl-indole-3-carbonyl)-N-(4-hydroxycyclohexyl)-2-piperazin-1-yl-pyridine-3-carboxamide CAS Name: 4-[(1,5-dimethyl-2-phenyl-3-indolyl)-oxomethyl]-N-(4-hydroxycyclohexyl)-2-(1-piperazinyl)-3-pyridinecarboxamide IUPAC Name: 4-(1,5-dimethyl-2-phenylindole-3-carbonyl)-N-(4-hydroxycyclohexyl)-2-piperazin-1-ylpyridine-3-carboxamide Traditional Name: 4-(1,5-dimethyl-2-phenyl-indole-3-carbonyl)-N-(4-hydroxycyclohexyl)-2-piperazino-nicotinamide Formula: C33H37N5O3 MolecularWeight: 551.67858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C(=O)C3=C(C(=NC=C3)N4CCNCC4)C(=O)NC5CCC(CC5)O)C6=CC=CC=C6)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C(=O)C3=C(C(=NC=C3)N4CCNCC4)C(=O)NC5CCC(CC5)O)C6=CC=CC=C6)C

InChI

InChI=1S/C33H37N5O3/c1-21-8-13-27-26(20-21)28(30(37(27)2)22-6-4-3-5-7-22)31(40)25-14-15-35-32(38-18-16-34-17-19-38)29(25)33(41)36-23-9-11-24(39)12-10-23/h3-8,13-15,20,23-24,34,39H,9-12,16-19H2,1-2H3,(H,36,41)