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Substance Name: Propanoic acid, 2-(((3-phenyl-1,2,4-oxadiazol-5-yl)methyl)thio)-, (+-)-
RN: 61560-12-1
InChIKey: XPLIFJPPGGRXNI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H12-N2-O3-S

Molecular Weight

  • 264.3038
 
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Names and Synonyms

Synonyms

  • (+-)-2-(((3-Phenyl-1,2,4-oxadiazol-5-yl)methyl)thio)propanoic acid
  • 2-(S-(3-Phenyl-1,2,4-oxadiazol-5-yl)methyl)thiopropionic acid

Systematic Name

  • Propanoic acid, 2-(((3-phenyl-1,2,4-oxadiazol-5-yl)methyl)thio)-, (+-)-

Registry Numbers

CAS Registry Number

  • 61560-12-1

System Generated Number

  • 0061560121

Structure Descriptors

InChI

1S/C12H12N2O3S/c1-8(12(15)16)18-7-10-13-11(14-17-10)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,15,16)

InChIKey

XPLIFJPPGGRXNI-UHFFFAOYSA-N

Smiles

CC(C(=O)O)SCc1nc(no1)c2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD oral > 240mg/kg (240mg/kg)   United States Patent Document. Vol. #4067988,