ethyl (2Z,4E)-2-cyano-5-(4-methylsulfanylphenyl)-3-phenyl-penta-2,4-dienoate

Systemtic Name: ethyl (2Z,4E)-2-cyano-5-(4-methylsulfanylphenyl)-3-phenyl-penta-2,4-dienoate Openeye Name: ethyl (2Z,4E)-2-cyano-5-(4-methylsulfanylphenyl)-3-phenyl-penta-2,4-dienoate CAS Name: (2Z,4E)-2-cyano-5-[4-(methylthio)phenyl]-3-phenylpenta-2,4-dienoic acid ethyl ester IUPAC Name: ethyl (2Z,4E)-2-cyano-5-(4-methylsulfanylphenyl)-3-phenylpenta-2,4-dienoate Traditional Name: (2Z,4E)-2-cyano-5-[4-(methylthio)phenyl]-3-phenyl-penta-2,4-dienoic acid ethyl ester Formula: C21H19NO2S MolecularWeight: 349.44606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C=CC1=CC=C(C=C1)SC)C2=CC=CC=C2)C#N

Isomeric SMILES

CCOC(=O)/C(=C(/C=C/C1=CC=C(C=C1)SC)\C2=CC=CC=C2)/C#N

InChI

InChI=1S/C21H19NO2S/c1-3-24-21(23)20(15-22)19(17-7-5-4-6-8-17)14-11-16-9-12-18(25-2)13-10-16/h4-14H,3H2,1-2H3/b14-11+,20-19-