S-(phenylmethyl) (E)-but-2-enethioate

Systemtic Name: S-(phenylmethyl) (E)-but-2-enethioate Openeye Name: S-benzyl (E)-but-2-enethioate CAS Name: (E)-2-butenethioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl (E)-but-2-enethioate Traditional Name: (E)-but-2-enethioic acid S-benzyl ester Formula: C11H12OS MolecularWeight: 192.27738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)SCC1=CC=CC=C1

Isomeric SMILES

C/C=C/C(=O)SCC1=CC=CC=C1

InChI

InChI=1S/C11H12OS/c1-2-6-11(12)13-9-10-7-4-3-5-8-10/h2-8H,9H2,1H3/b6-2+