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Substance Name: Barbituric acid, 5-allyl-5-(1-methylbutyl)-4-imino-2-thio-, sodium salt
RN: 64058-16-8
InChIKey: DDHBZUHWDGMLKV-UHFFFAOYSA-M

Molecular Formula

  • C12-H19-N3-O-S.Na

Molecular Weight

  • 275.35
 
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Names and Synonyms

Synonyms

  • 5-Allyl-5-(1-methylbutyl)-4-imino-2-thiobarbituric acid, sodium salt
  • USAF EL-22

Systematic Name

  • Barbituric acid, 5-allyl-5-(1-methylbutyl)-4-imino-2-thio-, sodium salt

Registry Numbers

CAS Registry Number

  • 64058-16-8

System Generated Number

  • 0064058168

Molecular Formulas

Molecular Formula

  • C12-H19-N3-O-S.Na

Molecular Formula Fragments

  • C12-H19-N3-O-S
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C12H19N3OS.Na/c1-4-6-8(3)12(7-5-2)9(13)14-11(17)15-10(12)16;/h5,8H,2,4,6-7H2,1,3H3,(H3,13,14,15,16,17);/q;+1/p-1

InChIKey

DDHBZUHWDGMLKV-UHFFFAOYSA-M

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 300mg/kg (300mg/kg)   National Technical Information Service. Vol. AD277-689,