3-[[5-(5-methyl-1,2-oxazol-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanoic acid

Systemtic Name: 3-[[5-(5-methyl-1,2-oxazol-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanoic acid Openeye Name: 3-[[5-(5-methylisoxazol-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanoic acid CAS Name: 3-[[5-(5-methyl-3-isoxazolyl)-1,3,4-oxadiazol-2-yl]thio]propanoic acid IUPAC Name: 3-[[5-(5-methyl-1,2-oxazol-3-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanoic acid Traditional Name: 3-[[5-(5-methylisoxazol-3-yl)-1,3,4-oxadiazol-2-yl]thio]propionic acid Formula: C9H9N3O4S MolecularWeight: 255.25046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C2=NN=C(O2)SCCC(=O)O

Isomeric SMILES

CC1=CC(=NO1)C2=NN=C(O2)SCCC(=O)O

InChI

InChI=1S/C9H9N3O4S/c1-5-4-6(12-16-5)8-10-11-9(15-8)17-3-2-7(13)14/h4H,2-3H2,1H3,(H,13,14)