methyl 2-(benzenecarbonothioylsulfanyl)-2-methyl-propanoate

Systemtic Name: methyl 2-(benzenecarbonothioylsulfanyl)-2-methyl-propanoate Openeye Name: methyl 2-(benzenecarbonothioylsulfanyl)-2-methyl-propanoate CAS Name: 2-(benzenecarbonothioylthio)-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-(benzenecarbonothioylsulfanyl)-2-methylpropanoate Traditional Name: 2-(benzenecarbonothioylthio)-2-methyl-propionic acid methyl ester Formula: C12H14O2S2 MolecularWeight: 254.36836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OC)SC(=S)C1=CC=CC=C1

Isomeric SMILES

CC(C)(C(=O)OC)SC(=S)C1=CC=CC=C1

InChI

InChI=1S/C12H14O2S2/c1-12(2,11(13)14-3)16-10(15)9-7-5-4-6-8-9/h4-8H,1-3H3