2-(1,2-oxazol-5-ylmethylsulfanyl)pyridine-3-carboxylic acid

Systemtic Name: 2-(1,2-oxazol-5-ylmethylsulfanyl)pyridine-3-carboxylic acid Openeye Name: 2-(isoxazol-5-ylmethylsulfanyl)pyridine-3-carboxylic acid CAS Name: 2-(5-isoxazolylmethylthio)-3-pyridinecarboxylic acid IUPAC Name: 2-(1,2-oxazol-5-ylmethylsulfanyl)pyridine-3-carboxylic acid Traditional Name: 2-(isoxazol-5-ylmethylthio)nicotinic acid Formula: C10H8N2O3S MolecularWeight: 236.24712

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC2=CC=NO2)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)SCC2=CC=NO2)C(=O)O

InChI

InChI=1S/C10H8N2O3S/c13-10(14)8-2-1-4-11-9(8)16-6-7-3-5-12-15-7/h1-5H,6H2,(H,13,14)