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Substance Name: Barbituric acid, 5-(bromopropenyl)-5-sec-butyl-, sodium salt
ID: CQ14095000
InChIKey: WITMQGCBPSZFPH-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H15-Br-N2-O3.Na

Molecular Weight

  • 325.1366
 
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Names and Synonyms

Synonym

  • 5-(Bromopropenyl)-5-sec-butylbarbituric acid sodium salt

Systematic Name

  • Barbituric acid, 5-(bromopropenyl)-5-sec-butyl-, sodium salt

Registry Numbers

ID Number

  • NIOSH/CQ1409500

System Generated Number

  • CQ14095000

Molecular Formulas

Molecular Formula

  • C11-H15-Br-N2-O3.Na

Molecular Formula Fragments

  • C11-H15-Br-N2-O3
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C11H15BrN2O3.Na/c1-4-6(2)11(5-7(3)12)8(15)13-10(17)14-9(11)16;/h6H,3-5H2,1-2H3,(H2,13,14,15,16,17);/q;+1/p-1

InChIKey

WITMQGCBPSZFPH-UHFFFAOYSA-M

Smiles

[Na+].CCC(C)C1(CC(=C)Br)C(=O)NC(=NC1=O)[O-]