ethyl 5-cyano-2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-(2-morpholinoethylsulfanyl)pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[2-(4-morpholinyl)ethylthio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-(2-morpholin-4-ylethylsulfanyl)pyridine-3-carboxylate Traditional Name: 5-cyano-2-methyl-6-(2-morpholinoethylthio)nicotinic acid ethyl ester Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCCN2CCOCC2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCCN2CCOCC2)C

InChI

InChI=1S/C16H21N3O3S/c1-3-22-16(20)14-10-13(11-17)15(18-12(14)2)23-9-6-19-4-7-21-8-5-19/h10H,3-9H2,1-2H3