ethyl (2Z,4E)-5-cyano-2-(dimethylamino)-5-phenylsulfanyl-penta-2,4-dienoate

Systemtic Name: ethyl (2Z,4E)-5-cyano-2-(dimethylamino)-5-phenylsulfanyl-penta-2,4-dienoate Openeye Name: ethyl (2Z,4E)-5-cyano-2-(dimethylamino)-5-phenylsulfanyl-penta-2,4-dienoate CAS Name: (2Z,4E)-5-cyano-2-(dimethylamino)-5-(phenylthio)penta-2,4-dienoic acid ethyl ester IUPAC Name: ethyl (2Z,4E)-5-cyano-2-(dimethylamino)-5-phenylsulfanylpenta-2,4-dienoate Traditional Name: (2Z,4E)-5-cyano-2-(dimethylamino)-5-(phenylthio)penta-2,4-dienoic acid ethyl ester Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC=C(C#N)SC1=CC=CC=C1)N(C)C

Isomeric SMILES

CCOC(=O)/C(=C/C=C(\C#N)/SC1=CC=CC=C1)/N(C)C

InChI

InChI=1S/C16H18N2O2S/c1-4-20-16(19)15(18(2)3)11-10-14(12-17)21-13-8-6-5-7-9-13/h5-11H,4H2,1-3H3/b14-10+,15-11-