ethyl 5-cyano-6-[2-(5-cyano-2-methyl-6-methylsulfanyl-pyridin-3-yl)-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[2-(5-cyano-2-methyl-6-methylsulfanyl-pyridin-3-yl)-2-oxidanylidene-ethyl]sulfanyl-2-oxidanylidene-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-(5-cyano-2-methyl-6-methylsulfanyl-3-pyridyl)-2-oxo-ethyl]sulfanyl-2-oxo-1H-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-[5-cyano-2-methyl-6-(methylthio)-3-pyridinyl]-2-oxoethyl]thio]-2-oxo-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-(5-cyano-2-methyl-6-methylsulfanylpyridin-3-yl)-2-oxoethyl]sulfanyl-2-oxo-1H-pyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-[5-cyano-2-methyl-6-(methylthio)-3-pyridyl]-2-keto-ethyl]thio]-2-keto-1H-pyridine-3-carboxylic acid ethyl ester Formula: C19H16N4O4S2 MolecularWeight: 428.48474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(NC1=O)SCC(=O)C2=C(N=C(C(=C2)C#N)SC)C)C#N

Isomeric SMILES

CCOC(=O)C1=CC(=C(NC1=O)SCC(=O)C2=C(N=C(C(=C2)C#N)SC)C)C#N

InChI

InChI=1S/C19H16N4O4S2/c1-4-27-19(26)14-6-12(8-21)18(23-16(14)25)29-9-15(24)13-5-11(7-20)17(28-3)22-10(13)2/h5-6H,4,9H2,1-3H3,(H,23,25)