S-(phenylmethyl) 4-methylpent-3-enethioate

Systemtic Name: S-(phenylmethyl) 4-methylpent-3-enethioate Openeye Name: S-benzyl 4-methylpent-3-enethioate CAS Name: 4-methyl-3-pentenethioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl 4-methylpent-3-enethioate Traditional Name: 4-methylpent-3-enethioic acid S-benzyl ester Formula: C13H16OS MolecularWeight: 220.33054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16OS/c1-11(2)8-9-13(14)15-10-12-6-4-3-5-7-12/h3-8H,9-10H2,1-2H3