3-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]benzoic acid

Systemtic Name: 3-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]benzoic acid Openeye Name: 3-[[5-(2-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoic acid CAS Name: 3-[[[5-(2-pyridinyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid IUPAC Name: 3-[(5-pyridin-2-yl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]benzoic acid Traditional Name: 3-[[[5-(2-pyridyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid Formula: C15H11N3O3S MolecularWeight: 313.33114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NN=C(O2)SCC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1=CC=NC(=C1)C2=NN=C(O2)SCC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C15H11N3O3S/c19-14(20)11-5-3-4-10(8-11)9-22-15-18-17-13(21-15)12-6-1-2-7-16-12/h1-8H,9H2,(H,19,20)