ethyl 5-cyano-6-[2-(4-ethoxyphenoxy)ethylsulfanyl]-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[2-(4-ethoxyphenoxy)ethylsulfanyl]-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-(4-ethoxyphenoxy)ethylsulfanyl]-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[2-(4-ethoxyphenoxy)ethylthio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-(4-ethoxyphenoxy)ethylsulfanyl]-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[2-(4-ethoxyphenoxy)ethylthio]-2-methyl-nicotinic acid ethyl ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCSC2=NC(=C(C=C2C#N)C(=O)OCC)C

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCSC2=NC(=C(C=C2C#N)C(=O)OCC)C

InChI

InChI=1S/C20H22N2O4S/c1-4-24-16-6-8-17(9-7-16)26-10-11-27-19-15(13-21)12-18(14(3)22-19)20(23)25-5-2/h6-9,12H,4-5,10-11H2,1-3H3