(Z)-5-(4-methoxyphenyl)-3-methylsulfanyl-5-oxidanylidene-2-(2-phenyl-1,3-thiazol-4-yl)pent-2-enenitrile

Systemtic Name: (Z)-5-(4-methoxyphenyl)-3-methylsulfanyl-5-oxidanylidene-2-(2-phenyl-1,3-thiazol-4-yl)pent-2-enenitrile Openeye Name: (Z)-5-(4-methoxyphenyl)-3-methylsulfanyl-5-oxo-2-(2-phenylthiazol-4-yl)pent-2-enenitrile CAS Name: (Z)-5-(4-methoxyphenyl)-3-(methylthio)-5-oxo-2-(2-phenyl-4-thiazolyl)-2-pentenenitrile IUPAC Name: (Z)-5-(4-methoxyphenyl)-3-methylsulfanyl-5-oxo-2-(2-phenyl-1,3-thiazol-4-yl)pent-2-enenitrile Traditional Name: (Z)-5-keto-5-(4-methoxyphenyl)-3-(methylthio)-2-(2-phenylthiazol-4-yl)pent-2-enenitrile Formula: C22H18N2O2S2 MolecularWeight: 406.52052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CC(=C(C#N)C2=CSC(=N2)C3=CC=CC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C/C(=C(/C#N)\C2=CSC(=N2)C3=CC=CC=C3)/SC

InChI

InChI=1S/C22H18N2O2S2/c1-26-17-10-8-15(9-11-17)20(25)12-21(27-2)18(13-23)19-14-28-22(24-19)16-6-4-3-5-7-16/h3-11,14H,12H2,1-2H3/b21-18+