2-[[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]propanoic acid

Systemtic Name: 2-[[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]propanoic acid Openeye Name: 2-[[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]propanoic acid CAS Name: 2-[[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]methylthio]propanoic acid IUPAC Name: 2-[[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]propanoic acid Traditional Name: 2-[[5-(4-chlorophenyl)-1,2,4-oxadiazol-3-yl]methylthio]propionic acid Formula: C12H11ClN2O3S MolecularWeight: 298.74534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC1=NOC(=N1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C(=O)O)SCC1=NOC(=N1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H11ClN2O3S/c1-7(12(16)17)19-6-10-14-11(18-15-10)8-2-4-9(13)5-3-8/h2-5,7H,6H2,1H3,(H,16,17)