2-(1,2,4-oxadiazol-5-ylmethylsulfanyl)benzoic acid

Systemtic Name: 2-(1,2,4-oxadiazol-5-ylmethylsulfanyl)benzoic acid Openeye Name: 2-(1,2,4-oxadiazol-5-ylmethylsulfanyl)benzoic acid CAS Name: 2-(1,2,4-oxadiazol-5-ylmethylthio)benzoic acid IUPAC Name: 2-(1,2,4-oxadiazol-5-ylmethylsulfanyl)benzoic acid Traditional Name: 2-(1,2,4-oxadiazol-5-ylmethylthio)benzoic acid Formula: C10H8N2O3S MolecularWeight: 236.24712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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