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Substance Name: Barbituric acid, 5-(1-(isobutylthio)ethyl)-5-propyl-, sodium salt
RN: 73664-49-0
InChIKey: JKSDFYSCYIONEE-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H22-N2-O3-S.Na

Molecular Weight

  • 308.3759
 
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Names and Synonyms

Synonyms

  • 5-(1-(Isobutylthio)ethyl)-5-propylbarbituric acid sodium salt
  • Sodium 5-(1-(isobutylthio)ethyl)-5-propylbarbiturate

Systematic Name

  • Barbituric acid, 5-(1-(isobutylthio)ethyl)-5-propyl-, sodium salt

Registry Numbers

CAS Registry Number

  • 73664-49-0

System Generated Number

  • 0073664490

Molecular Formulas

Molecular Formula

  • C13-H22-N2-O3-S.Na

Molecular Formula Fragments

  • C13-H22-N2-O3-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C13H22N2O3S.Na/c1-5-6-13(9(4)19-7-8(2)3)10(16)14-12(18)15-11(13)17;/h8-9H,5-7H2,1-4H3,(H2,14,15,16,17,18);/q;+1/p-1

InChIKey

JKSDFYSCYIONEE-UHFFFAOYSA-M

Smiles

[Na+].CCCC1(C(C)SCC(C)C)C(=O)NC(=O)[N-]C1=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 intravenous 116mg/kg (116mg/kg)   Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 35, Pg. 244, 1946.