3-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-sulfanyl-methyl]benzoic acid

Systemtic Name: 3-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-sulfanyl-methyl]benzoic acid Openeye Name: 3-[[5-(2-furyl)-1,3,4-oxadiazol-2-yl]-sulfanyl-methyl]benzoic acid CAS Name: 3-[[5-(2-furanyl)-1,3,4-oxadiazol-2-yl]-mercaptomethyl]benzoic acid IUPAC Name: 3-[[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-sulfanylmethyl]benzoic acid Traditional Name: 3-[[5-(2-furyl)-1,3,4-oxadiazol-2-yl]-mercapto-methyl]benzoic acid Formula: C14H10N2O4S MolecularWeight: 302.3052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(C2=NN=C(O2)C3=CC=CO3)S)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(C2=NN=C(O2)C3=CC=CO3)S)C(=O)O

InChI

InChI=1S/C14H10N2O4S/c17-14(18)9-4-1-3-8(7-9)11(21)13-16-15-12(20-13)10-5-2-6-19-10/h1-7,11,21H,(H,17,18)