S-(phenylmethyl) 3-oxidanylidenebutanethioate

Systemtic Name: S-(phenylmethyl) 3-oxidanylidenebutanethioate Openeye Name: S-benzyl 3-oxobutanethioate CAS Name: 3-oxobutanethioic acid S-(phenylmethyl) ester IUPAC Name: S-benzyl 3-oxobutanethioate Traditional Name: 3-ketobutanethioic acid S-benzyl ester Formula: C11H12O2S MolecularWeight: 208.27678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12O2S/c1-9(12)7-11(13)14-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3