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Substance Name: Barbituric acid, 1,5-dimethyl-5-(1-methylbutyl)-2-thio-, sodium salt
RN: 66941-09-1
InChIKey: VXDYIEYWFOZEMK-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H18-N2-O2-S.Na

Molecular Weight

  • 264.323
 
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Names and Synonyms

Synonym

  • 1,5-Dimethyl-5-(1-methylbutyl)-2-thiobarbituric acid sodium salt

Systematic Name

  • Barbituric acid, 1,5-dimethyl-5-(1-methylbutyl)-2-thio-, sodium salt

Registry Numbers

CAS Registry Number

  • 66941-09-1

System Generated Number

  • 0066941091

Molecular Formulas

Molecular Formula

  • C11-H18-N2-O2-S.Na

Molecular Formula Fragments

  • C11-H18-N2-O2-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C11H18N2O2S.Na/c1-5-6-7(2)11(3)8(14)12-10(16)13(4)9(11)15;/h7H,5-6H2,1-4H3,(H,12,14,16);/q;+1/p-1

InChIKey

VXDYIEYWFOZEMK-UHFFFAOYSA-M

Smiles

C1([C@@](C([NH-]C(N1C)=S)=O)([C@@H](CCC)C)C)=O.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 190mg/kg (190mg/kg)   Journal of Organic Chemistry. Vol. 5, Pg. 238, 1940.