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

Systemtic Name: 2-azanyl-3-[[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]propanoic acid Openeye Name: 2-amino-3-[[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]propanoic acid CAS Name: 2-amino-3-[[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methylthio]propanoic acid IUPAC Name: 2-amino-3-[[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methylsulfanyl]propanoic acid Traditional Name: 2-amino-3-[[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]methylthio]propionic acid Formula: C12H12FN3O3S MolecularWeight: 297.305383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=NO2)CSCC(C(=O)O)N)F

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=NO2)CSCC(C(=O)O)N)F

InChI

InChI=1S/C12H12FN3O3S/c13-8-3-1-7(2-4-8)11-15-10(16-19-11)6-20-5-9(14)12(17)18/h1-4,9H,5-6,14H2,(H,17,18)