ethyl 6,6-dicyano-2-ethanoyl-3-methylsulfanyl-5-phenyl-hexa-3,5-dienoate

Systemtic Name: ethyl 6,6-dicyano-2-ethanoyl-3-methylsulfanyl-5-phenyl-hexa-3,5-dienoate Openeye Name: ethyl 2-acetyl-6,6-dicyano-3-methylsulfanyl-5-phenyl-hexa-3,5-dienoate CAS Name: 2-acetyl-6,6-dicyano-3-(methylthio)-5-phenylhexa-3,5-dienoic acid ethyl ester IUPAC Name: ethyl 2-acetyl-6,6-dicyano-3-methylsulfanyl-5-phenylhexa-3,5-dienoate Traditional Name: 2-acetyl-6,6-dicyano-3-(methylthio)-5-phenyl-hexa-3,5-dienoic acid ethyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O3S/c1-4-24-19(23)18(13(2)22)17(25-3)10-16(15(11-20)12-21)14-8-6-5-7-9-14/h5-10,18H,4H2,1-3H3