ethyl 1-ethyl-2-(4-methylphenyl)carbonylsulfanyl-benzimidazole-5-carboxylate

Systemtic Name: ethyl 1-ethyl-2-(4-methylphenyl)carbonylsulfanyl-benzimidazole-5-carboxylate Openeye Name: ethyl 1-ethyl-2-(4-methylbenzoyl)sulfanyl-benzimidazole-5-carboxylate CAS Name: 1-ethyl-2-[[(4-methylphenyl)-oxomethyl]thio]-5-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-2-(4-methylbenzoyl)sulfanylbenzimidazole-5-carboxylate Traditional Name: 1-ethyl-2-(p-toluoylthio)benzimidazole-5-carboxylic acid ethyl ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)OCC)N=C1SC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C20H20N2O3S/c1-4-22-17-11-10-15(18(23)25-5-2)12-16(17)21-20(22)26-19(24)14-8-6-13(3)7-9-14/h6-12H,4-5H2,1-3H3