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

Systemtic Name: ethyl 5-cyano-6-[2-(5-cyano-2-methyl-6-methylsulfanyl-pyridin-3-yl)-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-(5-cyano-2-methyl-6-methylsulfanyl-3-pyridyl)-2-oxo-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-[5-cyano-2-methyl-6-(methylthio)-3-pyridinyl]-2-oxoethyl]thio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-(5-cyano-2-methyl-6-methylsulfanylpyridin-3-yl)-2-oxoethyl]sulfanyl-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-[5-cyano-2-methyl-6-(methylthio)-3-pyridyl]-2-keto-ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C20H18N4O3S2 MolecularWeight: 426.51192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18N4O3S2/c1-5-27-20(26)16-7-14(9-22)19(24-12(16)3)29-10-17(25)15-6-13(8-21)18(28-4)23-11(15)2/h6-7H,5,10H2,1-4H3