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

Systemtic Name: 4-(1,5-dimethyl-2-phenyl-indol-3-yl)carbonyl-N-(2-hydroxyethyl)-2-piperazin-1-yl-pyridine-3-carboxamide Openeye Name: 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)-2-(1-piperazinyl)-3-pyridinecarboxamide IUPAC Name: 4-(1,5-dimethyl-2-phenylindole-3-carbonyl)-N-(2-hydroxyethyl)-2-piperazin-1-ylpyridine-3-carboxamide Traditional Name: 4-(1,5-dimethyl-2-phenyl-indole-3-carbonyl)-N-(2-hydroxyethyl)-2-piperazino-nicotinamide Formula: C29H31N5O3 MolecularWeight: 497.58814

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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)NCCO)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C(=O)C3=C(C(=NC=C3)N4CCNCC4)C(=O)NCCO)C5=CC=CC=C5)C

InChI

InChI=1S/C29H31N5O3/c1-19-8-9-23-22(18-19)24(26(33(23)2)20-6-4-3-5-7-20)27(36)21-10-11-31-28(34-15-12-30-13-16-34)25(21)29(37)32-14-17-35/h3-11,18,30,35H,12-17H2,1-2H3,(H,32,37)