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Substance Name: 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-(m-tolyl)-, hydrochloride, (E)-
RN: 5583-20-0
InChIKey: FCWWULHEIMJNKF-OJERSXHUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H18-N2-O.Br-H

Molecular Weight

  • 311.221
 
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Names and Synonyms

Synonyms

  • (E)-Hexahydro-3-imino-1-(m-tolyl)-3H-oxazolo(3,4-a)pyridine hydrochloride
  • trans-3-Imino-1-(m-tolyl)hexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide

Systematic Name

  • 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-(m-tolyl)-, hydrochloride, (E)-

Registry Numbers

CAS Registry Number

  • 5583-20-0

System Generated Number

  • 0005583200

Molecular Formulas

Molecular Formula

  • C14-H18-N2-O.Br-H

Molecular Formula Fragments

  • Br-H
  • C14-H18-N2-O
  • COMPONENT

Structure Descriptors

InChI

1S/C14H18N2O.BrH/c1-10-5-4-6-11(9-10)13-12-7-2-3-8-16(12)14(15)17-13;/h4-6,9,12-13,15H,2-3,7-8H2,1H3;1H/t12-,13-;/m1./s1

InChIKey

FCWWULHEIMJNKF-OJERSXHUSA-N

Smiles

C1[C@H]2N(CCC1)C(O[C@@H]2c1cc(ccc1)C)=N.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 130mg/kg (130mg/kg) BRAIN AND COVERINGS: RECORDINGS FROM SPECIFIC AREAS OF CNS

VASCULAR: BP ELEVATION NOT CHARACTERIZED IN AUTONOMIC SECTION

BEHAVIORAL: EXCITEMENT
European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 15, Pg. 111, 1980.