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

Systemtic Name: 4-(1,5-dimethyl-2-phenyl-indol-3-yl)carbonyl-N-(2-phenoxyethyl)-2-piperazin-1-yl-pyridine-3-carboxamide hydrochloride Openeye Name: 4-(1,5-dimethyl-2-phenyl-indole-3-carbonyl)-N-(2-phenoxyethyl)-2-piperazin-1-yl-pyridine-3-carboxamide hydrochloride CAS Name: 4-[(1,5-dimethyl-2-phenyl-3-indolyl)-oxomethyl]-N-(2-phenoxyethyl)-2-(1-piperazinyl)-3-pyridinecarboxamide hydrochloride IUPAC Name: 4-(1,5-dimethyl-2-phenylindole-3-carbonyl)-N-(2-phenoxyethyl)-2-piperazin-1-ylpyridine-3-carboxamide hydrochloride Traditional Name: 4-(1,5-dimethyl-2-phenyl-indole-3-carbonyl)-N-(2-phenoxyethyl)-2-piperazino-nicotinamide hydrochloride Formula: C35H36ClN5O3 MolecularWeight: 610.14504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C(=O)C3=C(C(=NC=C3)N4CCNCC4)C(=O)NCCOC5=CC=CC=C5)C6=CC=CC=C6)C.Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C(=O)C3=C(C(=NC=C3)N4CCNCC4)C(=O)NCCOC5=CC=CC=C5)C6=CC=CC=C6)C.Cl

InChI

InChI=1S/C35H35N5O3.ClH/c1-24-13-14-29-28(23-24)30(32(39(29)2)25-9-5-3-6-10-25)33(41)27-15-16-37-34(40-20-17-36-18-21-40)31(27)35(42)38-19-22-43-26-11-7-4-8-12-26;/h3-16,23,36H,17-22H2,1-2H3,(H,38,42);1H