methyl 2-(2-cyanoethylsulfanyl)ethanoate

Systemtic Name: methyl 2-(2-cyanoethylsulfanyl)ethanoate Openeye Name: methyl 2-(2-cyanoethylsulfanyl)acetate CAS Name: 2-(2-cyanoethylthio)acetic acid methyl ester IUPAC Name: methyl 2-(2-cyanoethylsulfanyl)acetate Traditional Name: 2-(2-cyanoethylthio)acetic acid methyl ester Formula: C6H9NO2S MolecularWeight: 159.20616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCCC#N

Isomeric SMILES

COC(=O)CSCCC#N

InChI

InChI=1S/C6H9NO2S/c1-9-6(8)5-10-4-2-3-7/h2,4-5H2,1H3