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

Systemtic Name: 4-(1,5-dimethyl-2-phenyl-indol-3-yl)carbonyl-N-(2-hydroxyethyl)-N-(phenylmethyl)-2-piperazin-1-yl-pyridine-3-carboxamide Openeye Name: N-benzyl-4-(1,5-dimethyl-2-phenyl-indole-3-carbonyl)-N-(2-hydroxyethyl)-2-piperazin-1-yl-pyridine-3-carboxamide CAS Name: 4-[(1,5-dimethyl-2-phenyl-3-indolyl)-oxomethyl]-N-(2-hydroxyethyl)-N-(phenylmethyl)-2-(1-piperazinyl)-3-pyridinecarboxamide IUPAC Name: N-benzyl-4-(1,5-dimethyl-2-phenylindole-3-carbonyl)-N-(2-hydroxyethyl)-2-piperazin-1-ylpyridine-3-carboxamide Traditional Name: N-benzyl-4-(1,5-dimethyl-2-phenyl-indole-3-carbonyl)-N-(2-hydroxyethyl)-2-piperazino-nicotinamide Formula: C36H37N5O3 MolecularWeight: 587.71068

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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)N(CCO)CC5=CC=CC=C5)C6=CC=CC=C6)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C(=O)C3=C(C(=NC=C3)N4CCNCC4)C(=O)N(CCO)CC5=CC=CC=C5)C6=CC=CC=C6)C

InChI

InChI=1S/C36H37N5O3/c1-25-13-14-30-29(23-25)31(33(39(30)2)27-11-7-4-8-12-27)34(43)28-15-16-38-35(40-19-17-37-18-20-40)32(28)36(44)41(21-22-42)24-26-9-5-3-6-10-26/h3-16,23,37,42H,17-22,24H2,1-2H3