[2-[(2-methylquinolin-4-yl)amino]-2-oxidanylidene-ethyl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate

Systemtic Name: [2-[(2-methylquinolin-4-yl)amino]-2-oxidanylidene-ethyl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Openeye Name: [2-[(2-methyl-4-quinolyl)amino]-2-oxo-ethyl] 2-(p-tolyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylic acid [2-[(2-methyl-4-quinolinyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylquinolin-4-yl)amino]-2-oxoethyl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(p-tolyl)-3H-benzimidazole-5-carboxylic acid [2-keto-2-[(2-methyl-4-quinolyl)amino]ethyl] ester Formula: C27H22N4O3 MolecularWeight: 450.48858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)OCC(=O)NC4=CC(=NC5=CC=CC=C54)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)OCC(=O)NC4=CC(=NC5=CC=CC=C54)C

InChI

InChI=1S/C27H22N4O3/c1-16-7-9-18(10-8-16)26-30-22-12-11-19(14-24(22)31-26)27(33)34-15-25(32)29-23-13-17(2)28-21-6-4-3-5-20(21)23/h3-14H,15H2,1-2H3,(H,30,31)(H,28,29,32)