S-phenyl 3-oxidanylidene-2-(phenylmethyl)butanethioate

Systemtic Name: S-phenyl 3-oxidanylidene-2-(phenylmethyl)butanethioate Openeye Name: S-phenyl 2-benzyl-3-oxo-butanethioate CAS Name: 3-oxo-2-(phenylmethyl)butanethioic acid S-phenyl ester IUPAC Name: S-phenyl 2-benzyl-3-oxobutanethioate Traditional Name: 2-benzyl-3-keto-butanethioic acid S-phenyl ester Formula: C17H16O2S MolecularWeight: 284.37274

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=CC=C1)C(=O)SC2=CC=CC=C2

Isomeric SMILES

CC(=O)C(CC1=CC=CC=C1)C(=O)SC2=CC=CC=C2

InChI

InChI=1S/C17H16O2S/c1-13(18)16(12-14-8-4-2-5-9-14)17(19)20-15-10-6-3-7-11-15/h2-11,16H,12H2,1H3