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

Systemtic Name: [1-[(2,4-dimethoxyphenyl)amino]-1-oxidanylidene-butan-2-yl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Openeye Name: 1-[(2,4-dimethoxyphenyl)carbamoyl]propyl 2-(p-tolyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylic acid [1-(2,4-dimethoxyanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(2,4-dimethoxyanilino)-1-oxobutan-2-yl] 2-(4-methylphenyl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(p-tolyl)-3H-benzimidazole-5-carboxylic acid 1-[(2,4-dimethoxyphenyl)carbamoyl]propyl ester Formula: C27H27N3O5 MolecularWeight: 473.52038

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C=C1)OC)OC)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)C

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C=C1)OC)OC)OC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H27N3O5/c1-5-23(26(31)30-21-13-11-19(33-3)15-24(21)34-4)35-27(32)18-10-12-20-22(14-18)29-25(28-20)17-8-6-16(2)7-9-17/h6-15,23H,5H2,1-4H3,(H,28,29)(H,30,31)