methyl 2-[[2-(4-chlorophenyl)sulfanylphenyl]methylsulfanyl]benzoate

Systemtic Name: methyl 2-[[2-(4-chlorophenyl)sulfanylphenyl]methylsulfanyl]benzoate Openeye Name: methyl 2-[[2-(4-chlorophenyl)sulfanylphenyl]methylsulfanyl]benzoate CAS Name: 2-[[2-[(4-chlorophenyl)thio]phenyl]methylthio]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(4-chlorophenyl)sulfanylphenyl]methylsulfanyl]benzoate Traditional Name: 2-[[2-[(4-chlorophenyl)thio]benzyl]thio]benzoic acid methyl ester Formula: C21H17ClO2S2 MolecularWeight: 400.94148

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1SCC2=CC=CC=C2SC3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=CC=CC=C1SCC2=CC=CC=C2SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H17ClO2S2/c1-24-21(23)18-7-3-5-9-20(18)25-14-15-6-2-4-8-19(15)26-17-12-10-16(22)11-13-17/h2-13H,14H2,1H3