S-methyl 2-(2-methylphenyl)-2,2-bis(methylsulfanyl)ethanethioate

Systemtic Name: S-methyl 2-(2-methylphenyl)-2,2-bis(methylsulfanyl)ethanethioate Openeye Name: S-methyl 2,2-bis(methylsulfanyl)-2-(o-tolyl)ethanethioate CAS Name: 2-(2-methylphenyl)-2,2-bis(methylthio)ethanethioic acid S-methyl ester IUPAC Name: S-methyl 2-(2-methylphenyl)-2,2-bis(methylsulfanyl)ethanethioate Traditional Name: 2,2-bis(methylthio)-2-(o-tolyl)ethanethioic acid S-methyl ester Formula: C12H16OS3 MolecularWeight: 272.44984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C(=O)SC)(SC)SC

Isomeric SMILES

CC1=CC=CC=C1C(C(=O)SC)(SC)SC

InChI

InChI=1S/C12H16OS3/c1-9-7-5-6-8-10(9)12(15-3,16-4)11(13)14-2/h5-8H,1-4H3