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

Systemtic Name: (Z)-4-methyl-3-methylsulfanyl-5-oxidanylidene-2-(2-phenyl-1,3-thiazol-4-yl)hex-2-enenitrile Openeye Name: (Z)-4-methyl-3-methylsulfanyl-5-oxo-2-(2-phenylthiazol-4-yl)hex-2-enenitrile CAS Name: (Z)-4-methyl-3-(methylthio)-5-oxo-2-(2-phenyl-4-thiazolyl)-2-hexenenitrile IUPAC Name: (Z)-4-methyl-3-methylsulfanyl-5-oxo-2-(2-phenyl-1,3-thiazol-4-yl)hex-2-enenitrile Traditional Name: (Z)-5-keto-4-methyl-3-(methylthio)-2-(2-phenylthiazol-4-yl)hex-2-enenitrile Formula: C17H16N2OS2 MolecularWeight: 328.45174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)C(=C(C#N)C1=CSC(=N1)C2=CC=CC=C2)SC

Isomeric SMILES

CC(C(=O)C)/C(=C(/C#N)\C1=CSC(=N1)C2=CC=CC=C2)/SC

InChI

InChI=1S/C17H16N2OS2/c1-11(12(2)20)16(21-3)14(9-18)15-10-22-17(19-15)13-7-5-4-6-8-13/h4-8,10-11H,1-3H3/b16-14+