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

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

C1=CC=C(C(=C1)C2=NC(=NO2)CSCCC(=O)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC(=NO2)CSCCC(=O)O)Cl

InChI

InChI=1S/C12H11ClN2O3S/c13-9-4-2-1-3-8(9)12-14-10(15-18-12)7-19-6-5-11(16)17/h1-4H,5-7H2,(H,16,17)