S-[(4-methylphenyl)carbonylsulfanylmethyl] 4-methylbenzenecarbothioate

Systemtic Name: S-[(4-methylphenyl)carbonylsulfanylmethyl] 4-methylbenzenecarbothioate Openeye Name: S-[(4-methylbenzoyl)sulfanylmethyl] 4-methylbenzenecarbothioate CAS Name: 4-methylbenzenecarbothioic acid S-[[[(4-methylphenyl)-oxomethyl]thio]methyl] ester IUPAC Name: S-[(4-methylbenzoyl)sulfanylmethyl] 4-methylbenzenecarbothioate Traditional Name: 4-methylthiobenzoic acid S-[(p-toluoylthio)methyl] ester Formula: C17H16O2S2 MolecularWeight: 316.43774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16O2S2/c1-12-3-7-14(8-4-12)16(18)20-11-21-17(19)15-9-5-13(2)6-10-15/h3-10H,11H2,1-2H3