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Substance Name: Propanoic acid, 2-(((3-phenyl-1,2,4-oxadiazol-5-yl)methyl)thio)-, 2-(dimethylamino)ethyl ester, monohydrochloride
RN: 61560-13-2
InChIKey: FKYDTABNTLTPEW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H21-N3-O3-S.Cl-H

Molecular Weight

  • 371.8868
 
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Names and Synonyms

Synonym

  • Dimethylaminoethyl 2-(S-(3-phenyl-1,2,4-oxadiazol-5-yl)methyl)thiopropionate hydrochloride

Systematic Name

  • Propanoic acid, 2-(((3-phenyl-1,2,4-oxadiazol-5-yl)methyl)thio)-, 2-(dimethylamino)ethyl ester, monohydrochloride

Registry Numbers

CAS Registry Number

  • 61560-13-2

System Generated Number

  • 0061560132

Molecular Formulas

Molecular Formula

  • C16-H21-N3-O3-S.Cl-H

Molecular Formula Fragments

  • C16-H21-N3-O3-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H21N3O3S.ClH/c1-12(16(20)21-10-9-19(2)3)23-11-14-17-15(18-22-14)13-7-5-4-6-8-13;/h4-8,12H,9-11H2,1-3H3;1H

InChIKey

FKYDTABNTLTPEW-UHFFFAOYSA-N

Smiles

CC(C(=O)OCCN(C)C)SCc1nc(no1)c2ccccc2.Cl

Toxicity

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