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

Systemtic Name: 3-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoic acid Openeye Name: 3-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoic acid CAS Name: 3-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid IUPAC Name: 3-[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanylmethyl]benzoic acid Traditional Name: 3-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid Formula: C16H11ClN2O3S MolecularWeight: 346.78814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=NN=C(O2)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=NN=C(O2)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C16H11ClN2O3S/c17-13-6-4-11(5-7-13)14-18-19-16(22-14)23-9-10-2-1-3-12(8-10)15(20)21/h1-8H,9H2,(H,20,21)