2-(furan-2-ylmethylsulfanyl)pyridine-3-carboxylic acid

Systemtic Name: 2-(furan-2-ylmethylsulfanyl)pyridine-3-carboxylic acid Openeye Name: 2-(2-furylmethylsulfanyl)pyridine-3-carboxylic acid CAS Name: 2-(2-furanylmethylthio)-3-pyridinecarboxylic acid IUPAC Name: 2-(furan-2-ylmethylsulfanyl)pyridine-3-carboxylic acid Traditional Name: 2-(2-furfurylthio)nicotinic acid Formula: C11H9NO3S MolecularWeight: 235.25906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC2=CC=CO2)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)SCC2=CC=CO2)C(=O)O

InChI

InChI=1S/C11H9NO3S/c13-11(14)9-4-1-5-12-10(9)16-7-8-3-2-6-15-8/h1-6H,7H2,(H,13,14)