methyl 2-[[N-(4-chlorophenyl)-C-methylsulfanyl-carbonimidoyl]sulfanylmethyl]benzoate

Systemtic Name: methyl 2-[[N-(4-chlorophenyl)-C-methylsulfanyl-carbonimidoyl]sulfanylmethyl]benzoate Openeye Name: methyl 2-[[N-(4-chlorophenyl)-C-methylsulfanyl-carbonimidoyl]sulfanylmethyl]benzoate CAS Name: 2-[[[(4-chlorophenyl)imino-(methylthio)methyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[N-(4-chlorophenyl)-C-methylsulfanylcarbonimidoyl]sulfanylmethyl]benzoate Traditional Name: 2-[[[N-(4-chlorophenyl)-C-(methylthio)carbonimidoyl]thio]methyl]benzoic acid methyl ester Formula: C17H16ClNO2S2 MolecularWeight: 365.89744

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1CSC(=NC2=CC=C(C=C2)Cl)SC

Isomeric SMILES

COC(=O)C1=CC=CC=C1CSC(=NC2=CC=C(C=C2)Cl)SC

InChI

InChI=1S/C17H16ClNO2S2/c1-21-16(20)15-6-4-3-5-12(15)11-23-17(22-2)19-14-9-7-13(18)8-10-14/h3-10H,11H2,1-2H3