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

Systemtic Name: ethyl 5-cyano-2-methyl-6-[2-(3-methylphenoxy)ethylsulfanyl]pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-[2-(3-methylphenoxy)ethylsulfanyl]pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[2-(3-methylphenoxy)ethylthio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-[2-(3-methylphenoxy)ethylsulfanyl]pyridine-3-carboxylate Traditional Name: 5-cyano-2-methyl-6-[2-(3-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(=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCCOC2=CC=CC(=C2)C)C

InChI

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