N-[4-[[4-(3-methylphenyl)piperazin-1-yl]methyl]phenyl]quinoxaline-2-carboxamide

Systemtic Name: N-[4-[[4-(3-methylphenyl)piperazin-1-yl]methyl]phenyl]quinoxaline-2-carboxamide Openeye Name: N-[4-[[4-(m-tolyl)piperazin-1-yl]methyl]phenyl]quinoxaline-2-carboxamide CAS Name: N-[4-[[4-(3-methylphenyl)-1-piperazinyl]methyl]phenyl]-2-quinoxalinecarboxamide IUPAC Name: N-[4-[[4-(3-methylphenyl)piperazin-1-yl]methyl]phenyl]quinoxaline-2-carboxamide Traditional Name: N-[4-[[4-(m-tolyl)piperazino]methyl]phenyl]quinoxaline-2-carboxamide Formula: C27H27N5O MolecularWeight: 437.53618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CC3=CC=C(C=C3)NC(=O)C4=NC5=CC=CC=C5N=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CC3=CC=C(C=C3)NC(=O)C4=NC5=CC=CC=C5N=C4

InChI

InChI=1S/C27H27N5O/c1-20-5-4-6-23(17-20)32-15-13-31(14-16-32)19-21-9-11-22(12-10-21)29-27(33)26-18-28-24-7-2-3-8-25(24)30-26/h2-12,17-18H,13-16,19H2,1H3,(H,29,33)