[1-[(2-methylquinolin-4-yl)amino]-1-oxidanylidene-butan-2-yl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate

Systemtic Name: [1-[(2-methylquinolin-4-yl)amino]-1-oxidanylidene-butan-2-yl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Openeye Name: 1-[(2-methyl-4-quinolyl)carbamoyl]propyl 2-(p-tolyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylic acid [1-[(2-methyl-4-quinolinyl)amino]-1-oxobutan-2-yl] ester IUPAC Name: [1-[(2-methylquinolin-4-yl)amino]-1-oxobutan-2-yl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(p-tolyl)-3H-benzimidazole-5-carboxylic acid 1-[(2-methyl-4-quinolyl)carbamoyl]propyl ester Formula: C29H26N4O3 MolecularWeight: 478.54174

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=NC2=CC=CC=C21)C)OC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=C(C=C5)C

Isomeric SMILES

CCC(C(=O)NC1=CC(=NC2=CC=CC=C21)C)OC(=O)C3=CC4=C(C=C3)N=C(N4)C5=CC=C(C=C5)C

InChI

InChI=1S/C29H26N4O3/c1-4-26(28(34)33-24-15-18(3)30-22-8-6-5-7-21(22)24)36-29(35)20-13-14-23-25(16-20)32-27(31-23)19-11-9-17(2)10-12-19/h5-16,26H,4H2,1-3H3,(H,31,32)(H,30,33,34)