methyl 2,3-bis(methylsulfanyl)-3-phenyl-propanoate

Systemtic Name: methyl 2,3-bis(methylsulfanyl)-3-phenyl-propanoate Openeye Name: methyl 2,3-bis(methylsulfanyl)-3-phenyl-propanoate CAS Name: 2,3-bis(methylthio)-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2,3-bis(methylsulfanyl)-3-phenylpropanoate Traditional Name: 2,3-bis(methylthio)-3-phenyl-propionic acid methyl ester Formula: C12H16O2S2 MolecularWeight: 256.38424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C1=CC=CC=C1)SC)SC

Isomeric SMILES

COC(=O)C(C(C1=CC=CC=C1)SC)SC

InChI

InChI=1S/C12H16O2S2/c1-14-12(13)11(16-3)10(15-2)9-7-5-4-6-8-9/h4-8,10-11H,1-3H3