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Substance Name: Barbituric acid, 5-isobutyl-5-(methylthiomethyl)-2-thio-, sodium salt
RN: 67051-23-4
InChIKey: CMTKNFFTEYFHEP-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H16-N2-O2-S2.Na

Molecular Weight

  • 282.362
 
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Names and Synonyms

Synonyms

  • 5-Isobutyl-5-(methylthiomethyl)-2-thiobarbituric acid sodium salt
  • Sodium 5-isobutyl-5-(methylthiomethyl)-2-thiobartiturate

Systematic Name

  • Barbituric acid, 5-isobutyl-5-(methylthiomethyl)-2-thio-, sodium salt

Registry Numbers

CAS Registry Number

  • 67051-23-4

System Generated Number

  • 0067051234

Molecular Formulas

Molecular Formula

  • C10-H16-N2-O2-S2.Na

Molecular Formula Fragments

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

Structure Descriptors

InChI

1S/C10H16N2O2S2.Na/c1-6(2)4-10(5-16-3)7(13)11-9(15)12-8(10)14;/h6H,4-5H2,1-3H3,(H2,11,12,13,14,15);/q;+1/p-1

InChIKey

CMTKNFFTEYFHEP-UHFFFAOYSA-M

Smiles

C1(C(NC(=S)[NH-]C1=O)=O)(CC(C)C)CSC.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 intravenous 110mg/kg (110mg/kg)   Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 35, Pg. 244, 1946.