2-[(Z)-1-ethoxy-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile; ethyl 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: 2-[(Z)-1-ethoxy-1-oxidanyl-3-oxidanylidene-but-1-en-2-yl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile; ethyl 2-(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanyl-3-oxidanylidene-butanoate Openeye Name: 2-[(1Z)-1-[ethoxy(hydroxy)methylene]-2-oxo-propyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile; ethyl 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-3-oxo-butanoate CAS Name: 2-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-3-oxobutanoic acid ethyl ester; 2-[[(Z)-1-ethoxy-1-hydroxy-3-oxobut-1-en-2-yl]thio]-4,6-dimethyl-3-pyridinecarbonitrile IUPAC Name: 2-[(Z)-1-ethoxy-1-hydroxy-3-oxobut-1-en-2-yl]sulfanyl-4,6-dimethylpyridine-3-carbonitrile; ethyl 2-(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl-3-oxobutanoate Traditional Name: 2-[[(Z)-1-acetyl-2-ethoxy-2-hydroxy-vinyl]thio]-4,6-dimethyl-nicotinonitrile; 2-[(3-cyano-4,6-dimethyl-2-pyridyl)thio]-3-keto-butyric acid ethyl ester Formula: C28H32N4O6S2 MolecularWeight: 584.70688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C)SC1=C(C(=CC(=N1)C)C)C#N.CCOC(=C(C(=O)C)SC1=C(C(=CC(=N1)C)C)C#N)O

Isomeric SMILES

CCOC(=O)C(C(=O)C)SC1=C(C(=CC(=N1)C)C)C#N.CCO/C(=C(/C(=O)C)\SC1=C(C(=CC(=N1)C)C)C#N)/O

InChI

InChI=1S/2C14H16N2O3S/c2*1-5-19-14(18)12(10(4)17)20-13-11(7-15)8(2)6-9(3)16-13/h6,18H,5H2,1-4H3;6,12H,5H2,1-4H3/b14-12-;