S-[(E)-3-oxidanylidene-1-phenyl-but-1-en-2-yl] benzenecarbothioate

Systemtic Name: S-[(E)-3-oxidanylidene-1-phenyl-but-1-en-2-yl] benzenecarbothioate Openeye Name: S-[(1E)-1-benzylidene-2-oxo-propyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[(E)-3-oxo-1-phenylbut-1-en-2-yl] ester IUPAC Name: S-[(E)-3-oxo-1-phenylbut-1-en-2-yl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[(E)-1-acetyl-2-phenyl-vinyl] ester Formula: C17H14O2S MolecularWeight: 282.35686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)/C(=C\C1=CC=CC=C1)/SC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H14O2S/c1-13(18)16(12-14-8-4-2-5-9-14)20-17(19)15-10-6-3-7-11-15/h2-12H,1H3/b16-12+