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Substance Name: delta(sup 4)-1,2,4-Oxadiazoline, 5-((butylamino)methyl)-3-phenyl-, hydrochloride
RN: 102504-33-6
InChIKey: PITXPFQIZGFWFI-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H19-N3-O.Cl-H

Molecular Weight

  • 268.766
 
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Names and Synonyms

Synonym

  • 5-((Butylamino)methyl)-3-phenyl-delta(sup 4)-1,2,4-oxadiazoline hydrochloride

Systematic Name

  • delta(sup 4)-1,2,4-Oxadiazoline, 5-((butylamino)methyl)-3-phenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 102504-33-6

System Generated Number

  • 0102504336

Molecular Formulas

Molecular Formula

  • C13-H19-N3-O.Cl-H

Molecular Formula Fragments

  • C13-H19-N3-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C13H19N3O.ClH/c1-2-3-9-14-10-13-15-16(11-17-13)12-7-5-4-6-8-12;/h4-8,14H,2-3,9-11H2,1H3;1H/p-1

InChIKey

PITXPFQIZGFWFI-UHFFFAOYSA-M

Smiles

N1(c2ccccc2)N=C(CNCCCC)OC1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 687mg/kg (687mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Journal of Medicinal and Pharmaceutical Chemistry. Vol. 4, Pg. 351, 1961.