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Substance Name: Barbituric acid, 5-(2-butenyl)-5-propyl-2-thio-, sodium salt
RN: 67050-15-1
InChIKey: OKXYXEXCHCXZQV-WGCWOXMQSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-N2-O2-S.Na

Molecular Weight

  • 262.307
 
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Names and Synonyms

Synonym

  • 5-(2-Butenyl)-5-propyl-2-thiobarbituric acid sodium salt

Systematic Name

  • Barbituric acid, 5-(2-butenyl)-5-propyl-2-thio-, sodium salt

Registry Numbers

CAS Registry Number

  • 67050-15-1

System Generated Number

  • 0067050151

Molecular Formulas

Molecular Formula

  • C11-H16-N2-O2-S.Na

Molecular Formula Fragments

  • C11-H16-N2-O2-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C11H16N2O2S.Na/c1-3-5-7-11(6-4-2)8(14)12-10(16)13-9(11)15;/h3,5H,4,6-7H2,1-2H3,(H2,12,13,14,15,16);/q;+1/p-1/b5-3+;

InChIKey

OKXYXEXCHCXZQV-WGCWOXMQSA-M

Smiles

C1([C@@](C(N=C(N1)[S-])=O)(C\C=C\C)CCC)=O.[Na+]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 intravenous 121mg/kg (121mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 34, Pg. 183, 1945.
rat LD50 intraperitoneal 462mg/kg (462mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 34, Pg. 183, 1945.