ethyl 5-cyano-6-(cyanomethylsulfanyl)-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-(cyanomethylsulfanyl)-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-(cyanomethylsulfanyl)-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-(cyanomethylthio)-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-(cyanomethylsulfanyl)-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-(cyanomethylthio)-2-methyl-nicotinic acid ethyl ester Formula: C12H11N3O2S MolecularWeight: 261.29964

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11N3O2S/c1-3-17-12(16)10-6-9(7-14)11(15-8(10)2)18-5-4-13/h6H,3,5H2,1-2H3