2-[(4-acetamidophenyl)sulfanylmethyl]-1-ethyl-benzimidazole-5-carboxylate

Systemtic Name: 2-[(4-acetamidophenyl)sulfanylmethyl]-1-ethyl-benzimidazole-5-carboxylate Openeye Name: 2-[(4-acetamidophenyl)sulfanylmethyl]-1-ethyl-benzimidazole-5-carboxylate CAS Name: 2-[[(4-acetamidophenyl)thio]methyl]-1-ethyl-5-benzimidazolecarboxylate IUPAC Name: 2-[(4-acetamidophenyl)sulfanylmethyl]-1-ethylbenzimidazole-5-carboxylate Traditional Name: 2-[[(4-acetamidophenyl)thio]methyl]-1-ethyl-benzimidazole-5-carboxylate Formula: C19H18N3O3S- MolecularWeight: 368.42952

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)[O-])N=C1CSC3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)[O-])N=C1CSC3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C19H19N3O3S/c1-3-22-17-9-4-13(19(24)25)10-16(17)21-18(22)11-26-15-7-5-14(6-8-15)20-12(2)23/h4-10H,3,11H2,1-2H3,(H,20,23)(H,24,25)/p-1