ethyl 5-cyano-2-methyl-6-methylsulfanyl-4-phenyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-6-methylsulfanyl-4-phenyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-methylsulfanyl-4-phenyl-pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-(methylthio)-4-phenyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-methylsulfanyl-4-phenylpyridine-3-carboxylate Traditional Name: 5-cyano-2-methyl-6-(methylthio)-4-phenyl-nicotinic acid ethyl ester Formula: C17H16N2O2S MolecularWeight: 312.38614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1C2=CC=CC=C2)C#N)SC)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1C2=CC=CC=C2)C#N)SC)C

InChI

InChI=1S/C17H16N2O2S/c1-4-21-17(20)14-11(2)19-16(22-3)13(10-18)15(14)12-8-6-5-7-9-12/h5-9H,4H2,1-3H3