ethyl 5-cyano-2-methyl-6-[2-(2-methylphenoxy)ethylsulfanyl]pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-6-[2-(2-methylphenoxy)ethylsulfanyl]pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-[2-(2-methylphenoxy)ethylsulfanyl]pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[2-(2-methylphenoxy)ethylthio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-[2-(2-methylphenoxy)ethylsulfanyl]pyridine-3-carboxylate Traditional Name: 5-cyano-2-methyl-6-[2-(2-methylphenoxy)ethylthio]nicotinic acid ethyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCCOC2=CC=CC=C2C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCCOC2=CC=CC=C2C)C

InChI

InChI=1S/C19H20N2O3S/c1-4-23-19(22)16-11-15(12-20)18(21-14(16)3)25-10-9-24-17-8-6-5-7-13(17)2/h5-8,11H,4,9-10H2,1-3H3