S-methyl 3-(4-methylphenyl)sulfanyl-3-phenyl-propanethioate

Systemtic Name: S-methyl 3-(4-methylphenyl)sulfanyl-3-phenyl-propanethioate Openeye Name: S-methyl 3-phenyl-3-(p-tolylsulfanyl)propanethioate CAS Name: 3-[(4-methylphenyl)thio]-3-phenylpropanethioic acid S-methyl ester IUPAC Name: S-methyl 3-(4-methylphenyl)sulfanyl-3-phenylpropanethioate Traditional Name: 3-phenyl-3-(p-tolylthio)propanethioic acid S-methyl ester Formula: C17H18OS2 MolecularWeight: 302.45422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(CC(=O)SC)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)SC(CC(=O)SC)C2=CC=CC=C2

InChI

InChI=1S/C17H18OS2/c1-13-8-10-15(11-9-13)20-16(12-17(18)19-2)14-6-4-3-5-7-14/h3-11,16H,12H2,1-2H3