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

Systemtic Name: methyl 4-azanyl-5-cyano-2-ethyl-6-methylsulfanyl-pyridine-3-carboxylate Openeye Name: methyl 4-amino-5-cyano-2-ethyl-6-methylsulfanyl-pyridine-3-carboxylate CAS Name: 4-amino-5-cyano-2-ethyl-6-(methylthio)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 4-amino-5-cyano-2-ethyl-6-methylsulfanylpyridine-3-carboxylate Traditional Name: 4-amino-5-cyano-2-ethyl-6-(methylthio)nicotinic acid methyl ester Formula: C11H13N3O2S MolecularWeight: 251.30482

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=N1)SC)C#N)N)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(C(=N1)SC)C#N)N)C(=O)OC

InChI

InChI=1S/C11H13N3O2S/c1-4-7-8(11(15)16-2)9(13)6(5-12)10(14-7)17-3/h4H2,1-3H3,(H2,13,14)