methyl 3-(5-cyanopyridin-2-yl)sulfanylpropanoate

Systemtic Name: methyl 3-(5-cyanopyridin-2-yl)sulfanylpropanoate Openeye Name: methyl 3-[(5-cyano-2-pyridyl)sulfanyl]propanoate CAS Name: 3-[(5-cyano-2-pyridinyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(5-cyanopyridin-2-yl)sulfanylpropanoate Traditional Name: 3-[(5-cyano-2-pyridyl)thio]propionic acid methyl ester Formula: C10H10N2O2S MolecularWeight: 222.2636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=NC=C(C=C1)C#N

Isomeric SMILES

COC(=O)CCSC1=NC=C(C=C1)C#N

InChI

InChI=1S/C10H10N2O2S/c1-14-10(13)4-5-15-9-3-2-8(6-11)7-12-9/h2-3,7H,4-5H2,1H3