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

Systemtic Name: 6-(furan-2-ylmethylsulfanyl)pyridine-3-carboxylic acid Openeye Name: 6-(2-furylmethylsulfanyl)pyridine-3-carboxylic acid CAS Name: 6-(2-furanylmethylthio)-3-pyridinecarboxylic acid IUPAC Name: 6-(furan-2-ylmethylsulfanyl)pyridine-3-carboxylic acid Traditional Name: 6-(2-furfurylthio)nicotinic acid Formula: C11H9NO3S MolecularWeight: 235.25906

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CSC2=NC=C(C=C2)C(=O)O

Isomeric SMILES

C1=COC(=C1)CSC2=NC=C(C=C2)C(=O)O

InChI

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