2-pyridin-4-ylsulfanylethanoate

Systemtic Name: 2-pyridin-4-ylsulfanylethanoate Openeye Name: 2-(4-pyridylsulfanyl)acetate CAS Name: 2-(pyridin-4-ylthio)acetate IUPAC Name: 2-pyridin-4-ylsulfanylacetate Traditional Name: 2-(4-pyridylthio)acetate Formula: C7H6NO2S- MolecularWeight: 168.19304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1SCC(=O)[O-]

Isomeric SMILES

C1=CN=CC=C1SCC(=O)[O-]

InChI

InChI=1S/C7H7NO2S/c9-7(10)5-11-6-1-3-8-4-2-6/h1-4H,5H2,(H,9,10)/p-1