methyl 3-(benzenecarbonothioylsulfanyl)-2-methyl-propanoate

Systemtic Name: methyl 3-(benzenecarbonothioylsulfanyl)-2-methyl-propanoate Openeye Name: methyl 3-(benzenecarbonothioylsulfanyl)-2-methyl-propanoate CAS Name: 3-(benzenecarbonothioylthio)-2-methylpropanoic acid methyl ester IUPAC Name: methyl 3-(benzenecarbonothioylsulfanyl)-2-methylpropanoate Traditional Name: 3-(benzenecarbonothioylthio)-2-methyl-propionic acid methyl ester Formula: C12H14O2S2 MolecularWeight: 254.36836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14O2S2/c1-9(11(13)14-2)8-16-12(15)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3