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Substance Name: Barbituric acid, 5-ethyl-5-(pentylthiomethyl)-, sodium salt
RN: 67050-87-7
InChIKey: NBNFQBJIXDLPHC-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H20-N2-O3-S.Na

Molecular Weight

  • 294.3491
 
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Names and Synonyms

Synonyms

  • 5-Ethyl-5-(pentylthiomethyl)barbituric acid sodium salt
  • Sodium 5-ethyl-5-(pentylthiomethyl)barbiturate

Systematic Name

  • Barbituric acid, 5-ethyl-5-(pentylthiomethyl)-, sodium salt

Registry Numbers

CAS Registry Number

  • 67050-87-7

System Generated Number

  • 0067050877

Molecular Formulas

Molecular Formula

  • C12-H20-N2-O3-S.Na

Molecular Formula Fragments

  • C12-H20-N2-O3-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C12H20N2O3S.Na/c1-3-5-6-7-18-8-12(4-2)9(15)13-11(17)14-10(12)16;/h3-8H2,1-2H3,(H2,13,14,15,16,17);/q;+1/p-1

InChIKey

NBNFQBJIXDLPHC-UHFFFAOYSA-M

Smiles

[Na+].CCCCCSCC1(CC)C(=O)NC(=O)[N-]C1=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 191mg/kg (191mg/kg)   Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 35, Pg. 231, 1946.
rabbit LD50 intravenous 53mg/kg (53mg/kg)   Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 35, Pg. 244, 1946.