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Substance Name: Barbituric acid, 5-(ethylthiomethyl)-5-(2-methylallyl)-, sodium salt
RN: 67051-14-3
InChIKey: ZGIKOGWKYUMIRF-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-N2-O3-S.Na

Molecular Weight

  • 278.3065
 
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Names and Synonyms

Synonyms

  • 5-(Ethylthiomethyl)-5-(2-methylallyl)barbituric acid sodium salt
  • Sodium 5-(ethylthiomethyl)-5-(2-methylallyl)barbiturate

Systematic Name

  • Barbituric acid, 5-(ethylthiomethyl)-5-(2-methylallyl)-, sodium salt

Registry Numbers

CAS Registry Number

  • 67051-14-3

System Generated Number

  • 0067051143

Molecular Formulas

Molecular Formula

  • C11-H16-N2-O3-S.Na

Molecular Formula Fragments

  • C11-H16-N2-O3-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C11H16N2O3S.Na/c1-4-17-6-11(5-7(2)3)8(14)12-10(16)13-9(11)15;/h2,4-6H2,1,3H3,(H2,12,13,14,15,16);/q;+1/p-1

InChIKey

ZGIKOGWKYUMIRF-UHFFFAOYSA-M

Smiles

[Na+].CCSCC1(CC(=C)C)C(=O)NC(=O)[N-]C1=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 250mg/kg (250mg/kg)   Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 35, Pg. 231, 1946.