ethyl 2-[3-cyano-6-(3-methoxyphenyl)pyridin-2-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[3-cyano-6-(3-methoxyphenyl)pyridin-2-yl]sulfanylethanoate Openeye Name: ethyl 2-[[3-cyano-6-(3-methoxyphenyl)-2-pyridyl]sulfanyl]acetate CAS Name: 2-[[3-cyano-6-(3-methoxyphenyl)-2-pyridinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-cyano-6-(3-methoxyphenyl)pyridin-2-yl]sulfanylacetate Traditional Name: 2-[[3-cyano-6-(3-methoxyphenyl)-2-pyridyl]thio]acetic acid ethyl ester Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C=CC(=N1)C2=CC(=CC=C2)OC)C#N

Isomeric SMILES

CCOC(=O)CSC1=C(C=CC(=N1)C2=CC(=CC=C2)OC)C#N

InChI

InChI=1S/C17H16N2O3S/c1-3-22-16(20)11-23-17-13(10-18)7-8-15(19-17)12-5-4-6-14(9-12)21-2/h4-9H,3,11H2,1-2H3