methyl 2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzimidazole-1-carboxylate

Systemtic Name: methyl 2-[2-[(4-chlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylbenzimidazole-1-carboxylate Openeye Name: methyl 2-[2-(4-chloroanilino)-2-oxo-ethyl]sulfanylbenzimidazole-1-carboxylate CAS Name: 2-[[2-(4-chloroanilino)-2-oxoethyl]thio]-1-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-(4-chloroanilino)-2-oxoethyl]sulfanylbenzimidazole-1-carboxylate Traditional Name: 2-[[2-(4-chloroanilino)-2-keto-ethyl]thio]benzimidazole-1-carboxylic acid methyl ester Formula: C17H14ClN3O3S MolecularWeight: 375.82936

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)N1C2=CC=CC=C2N=C1SCC(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN3O3S/c1-24-17(23)21-14-5-3-2-4-13(14)20-16(21)25-10-15(22)19-12-8-6-11(18)7-9-12/h2-9H,10H2,1H3,(H,19,22)