ethyl 2-(5-cyanopyridin-2-yl)sulfanylpropanoate

Systemtic Name: ethyl 2-(5-cyanopyridin-2-yl)sulfanylpropanoate Openeye Name: ethyl 2-[(5-cyano-2-pyridyl)sulfanyl]propanoate CAS Name: 2-[(5-cyano-2-pyridinyl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 2-(5-cyanopyridin-2-yl)sulfanylpropanoate Traditional Name: 2-[(5-cyano-2-pyridyl)thio]propionic acid ethyl ester Formula: C11H12N2O2S MolecularWeight: 236.29018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=NC=C(C=C1)C#N

Isomeric SMILES

CCOC(=O)C(C)SC1=NC=C(C=C1)C#N

InChI

InChI=1S/C11H12N2O2S/c1-3-15-11(14)8(2)16-10-5-4-9(6-12)7-13-10/h4-5,7-8H,3H2,1-2H3