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

Systemtic Name: [1-[(2-methoxycarbonylphenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Openeye Name: 1-[(2-methoxycarbonylphenyl)carbamoyl]propyl 2-(p-tolyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylic acid [1-(2-methoxycarbonylanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2-methoxycarbonylanilino)-1-oxobutan-2-yl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(p-tolyl)-3H-benzimidazole-5-carboxylic acid 1-[(2-carbomethoxyphenyl)carbamoyl]propyl ester Formula: C27H25N3O5 MolecularWeight: 471.5045

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)OC)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)OC)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H25N3O5/c1-4-23(25(31)30-20-8-6-5-7-19(20)27(33)34-3)35-26(32)18-13-14-21-22(15-18)29-24(28-21)17-11-9-16(2)10-12-17/h5-15,23H,4H2,1-3H3,(H,28,29)(H,30,31)