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Substance Name: Barbituric acid, 5-(4-(diethylamino)-2-butynyl)-5-ethyl-, hydrochloride
RN: 1907-86-4
InChIKey: XVOZTRVNPANHRB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H21-N3-O3.Cl-H

Molecular Weight

  • 315.799
 
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Names and Synonyms

Synonyms

  • 5-(4-(Diethylamino)-2-butynyl)-5-ethylbarbituric acid hydrochloride
  • 5-Ethyl-5-(4-diethylamino-2-butynyl)barbituric acid hydrochloride

Systematic Name

  • Barbituric acid, 5-(4-(diethylamino)-2-butynyl)-5-ethyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 1907-86-4

System Generated Number

  • 0001907864

Molecular Formulas

Molecular Formula

  • C14-H21-N3-O3.Cl-H

Molecular Formula Fragments

  • C14-H21-N3-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H21N3O3.ClH/c1-4-14(9-7-8-10-17(5-2)6-3)11(18)15-13(20)16-12(14)19;/h4-6,9-10H2,1-3H3,(H2,15,16,18,19,20);1H

InChIKey

XVOZTRVNPANHRB-UHFFFAOYSA-N

Smiles

C1(C(NC(=O)NC1=O)=O)(CC#CC[NH+](CC)CC)CC.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   Acta Pharmaceutica Suecica. Vol. 1, Pg. 91, 1964.