2-(furan-2-ylmethylsulfanyl)pyridine-4-carboxylic acid

Systemtic Name: 2-(furan-2-ylmethylsulfanyl)pyridine-4-carboxylic acid Openeye Name: 2-(2-furylmethylsulfanyl)pyridine-4-carboxylic acid CAS Name: 2-(2-furanylmethylthio)-4-pyridinecarboxylic acid IUPAC Name: 2-(furan-2-ylmethylsulfanyl)pyridine-4-carboxylic acid Traditional Name: 2-(2-furfurylthio)isonicotinic acid Formula: C11H9NO3S MolecularWeight: 235.25906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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