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

Systemtic Name: 2-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]pyridine-3-carboxylic acid Openeye Name: 2-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyridine-3-carboxylic acid CAS Name: 2-[[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-3-pyridinecarboxylic acid IUPAC Name: 2-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]pyridine-3-carboxylic acid Traditional Name: 2-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methylthio]nicotinic acid Formula: C13H9N3O3S2 MolecularWeight: 319.35886

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9N3O3S2/c17-13(18)9-2-1-4-14-12(9)21-7-10-15-11(16-19-10)8-3-5-20-6-8/h1-6H,7H2,(H,17,18)