(2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate

Systemtic Name: (2-oxidanylidene-2-thiophen-2-yl-ethyl) 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate Openeye Name: [2-oxo-2-(2-thienyl)ethyl] 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate CAS Name: 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylic acid (2-oxo-2-thiophen-2-ylethyl) ester IUPAC Name: (2-oxo-2-thiophen-2-ylethyl) 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylate Traditional Name: 2-(4-methoxyphenyl)-3H-benzimidazole-5-carboxylic acid [2-keto-2-(2-thienyl)ethyl] ester Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)OCC(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C(=O)OCC(=O)C4=CC=CS4

InChI

InChI=1S/C21H16N2O4S/c1-26-15-7-4-13(5-8-15)20-22-16-9-6-14(11-17(16)23-20)21(25)27-12-18(24)19-3-2-10-28-19/h2-11H,12H2,1H3,(H,22,23)