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Substance Name: Barbituric acid, 5-(1-(methylthio)ethyl)-5-propyl-2-thio-, sodium salt
RN: 66843-08-1
InChIKey: HJQLILKRMRHCNU-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H16-N2-O2-S2.Na

Molecular Weight

  • 324.443
 
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Names and Synonyms

Synonyms

  • 5-(1-(Methylthio)ethyl)-5-propyl-2-thiobarbituric acid sodium salt
  • Sodium 5-(1-(methylthio)ethyl)-5-propyl-2-thiobarbiturate

Systematic Name

  • Barbituric acid, 5-(1-(methylthio)ethyl)-5-propyl-2-thio-, sodium salt

Registry Numbers

CAS Registry Number

  • 66843-08-1

System Generated Number

  • 0066843081

Molecular Formulas

Molecular Formula

  • C10-H16-N2-O2-S2.Na

Molecular Formula Fragments

  • C10-H16-N2-O2-S2
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C13H22N2O2S2.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

HJQLILKRMRHCNU-UHFFFAOYSA-M

Smiles

C1(C(NC(=S)[NH-]C1=O)=O)([C@@H](SCC(C)C)C)CCC.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 intravenous 103mg/kg (103mg/kg)   Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 35, Pg. 244, 1946.