ethyl 6-[(5-chloranyl-2-methoxy-phenyl)methylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 6-[(5-chloranyl-2-methoxy-phenyl)methylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 6-[(5-chloro-2-methoxy-phenyl)methylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate CAS Name: 6-[(5-chloro-2-methoxyphenyl)methylthio]-5-cyano-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[(5-chloro-2-methoxyphenyl)methylsulfanyl]-5-cyano-2-methylpyridine-3-carboxylate Traditional Name: 6-[(5-chloro-2-methoxy-benzyl)thio]-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)SCC2=C(C=CC(=C2)Cl)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=C(C=CC(=C2)Cl)OC)C

InChI

InChI=1S/C18H17ClN2O3S/c1-4-24-18(22)15-8-12(9-20)17(21-11(15)2)25-10-13-7-14(19)5-6-16(13)23-3/h5-8H,4,10H2,1-3H3