S-[2-(phenylcarbonyl)butyl] ethanethioate

Systemtic Name: S-[2-(phenylcarbonyl)butyl] ethanethioate Openeye Name: S-(2-benzoylbutyl) ethanethioate CAS Name: ethanethioic acid S-(2-benzoylbutyl) ester IUPAC Name: S-(2-benzoylbutyl) ethanethioate Traditional Name: ethanethioic acid S-(2-benzoylbutyl) ester Formula: C13H16O2S MolecularWeight: 236.32994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CSC(=O)C)C(=O)C1=CC=CC=C1

Isomeric SMILES

CCC(CSC(=O)C)C(=O)C1=CC=CC=C1

InChI

InChI=1S/C13H16O2S/c1-3-11(9-16-10(2)14)13(15)12-7-5-4-6-8-12/h4-8,11H,3,9H2,1-2H3