2-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyridine-3-carboxylic acid

Systemtic Name: 2-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-[[3-(2-furyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[[3-(2-furanyl)-1,2,4-oxadiazol-5-yl]methylthio]-3-pyridinecarboxylic acid IUPAC Name: 2-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyridine-3-carboxylic acid Traditional Name: 2-[[3-(2-furyl)-1,2,4-oxadiazol-5-yl]methylthio]nicotinic acid Formula: C13H9N3O4S MolecularWeight: 303.29326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SCC2=NC(=NO2)C3=CC=CO3)C(=O)O

Isomeric SMILES

C1=CC(=C(N=C1)SCC2=NC(=NO2)C3=CC=CO3)C(=O)O

InChI

InChI=1S/C13H9N3O4S/c17-13(18)8-3-1-5-14-12(8)21-7-10-15-11(16-20-10)9-4-2-6-19-9/h1-6H,7H2,(H,17,18)