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

Systemtic Name: ethyl 6-[2-(3-chloranylphenoxy)ethylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 6-[2-(3-chlorophenoxy)ethylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate CAS Name: 6-[2-(3-chlorophenoxy)ethylthio]-5-cyano-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[2-(3-chlorophenoxy)ethylsulfanyl]-5-cyano-2-methylpyridine-3-carboxylate Traditional Name: 6-[2-(3-chlorophenoxy)ethylthio]-5-cyano-2-methyl-nicotinic acid ethyl ester Formula: C18H17ClN2O3S MolecularWeight: 376.85718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN2O3S/c1-3-23-18(22)16-9-13(11-20)17(21-12(16)2)25-8-7-24-15-6-4-5-14(19)10-15/h4-6,9-10H,3,7-8H2,1-2H3