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

Systemtic Name: ethyl 5-cyano-6-[2-(2-fluoranylphenoxy)ethylsulfanyl]-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-(2-fluorophenoxy)ethylsulfanyl]-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[2-(2-fluorophenoxy)ethylthio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-(2-fluorophenoxy)ethylsulfanyl]-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[2-(2-fluorophenoxy)ethylthio]-2-methyl-nicotinic acid ethyl ester Formula: C18H17FN2O3S MolecularWeight: 360.402583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCCOC2=CC=CC=C2F)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCCOC2=CC=CC=C2F)C

InChI

InChI=1S/C18H17FN2O3S/c1-3-23-18(22)14-10-13(11-20)17(21-12(14)2)25-9-8-24-16-7-5-4-6-15(16)19/h4-7,10H,3,8-9H2,1-2H3