S-ethyl (E,2E)-4-methyl-3-oxidanylidene-2-(phenylmethylidene)hex-4-enethioate

Systemtic Name: S-ethyl (E,2E)-4-methyl-3-oxidanylidene-2-(phenylmethylidene)hex-4-enethioate Openeye Name: S-ethyl (E,2E)-2-benzylidene-4-methyl-3-oxo-hex-4-enethioate CAS Name: (E,2E)-4-methyl-3-oxo-2-(phenylmethylene)-4-hexenethioic acid S-ethyl ester IUPAC Name: S-ethyl (E,2E)-2-benzylidene-4-methyl-3-oxohex-4-enethioate Traditional Name: (E,2E)-2-benzal-3-keto-4-methyl-hex-4-enethioic acid S-ethyl ester Formula: C16H18O2S MolecularWeight: 274.37792

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=O)C(=CC1=CC=CC=C1)C(=O)C(=CC)C

Isomeric SMILES

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

InChI

InChI=1S/C16H18O2S/c1-4-12(3)15(17)14(16(18)19-5-2)11-13-9-7-6-8-10-13/h4,6-11H,5H2,1-3H3/b12-4+,14-11+