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Substance Name: Barbituric acid, 5-(2-cyclopentenyl)-5-propyl-2-thio-
RN: 66940-69-0
InChIKey: DFUBOMNQHZYIFQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H16-N2-O2-S

Molecular Weight

  • 252.336
 
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Names and Synonyms

Synonyms

  • 4-24-00-02053 (Beilstein Handbook Reference)
  • 5-(2-Cyclopentenyl)-5-propyl-2-thiobarbituric acid
  • BRN 0262412

Systematic Name

  • Barbituric acid, 5-(2-cyclopentenyl)-5-propyl-2-thio-

Registry Numbers

CAS Registry Number

  • 66940-69-0

System Generated Number

  • 0066940690

Structure Descriptors

InChI

1S/C12H16N2O2S/c1-2-7-12(8-5-3-4-6-8)9(15)13-11(17)14-10(12)16/h3,5,8H,2,4,6-7H2,1H3,(H2,13,14,15,16,17)

InChIKey

DFUBOMNQHZYIFQ-UHFFFAOYSA-N

Smiles

C1([C@@H]2CCC=C2)(C(NC(=S)NC1=O)=O)CCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 250mg/kg (250mg/kg)   Journal of the American Chemical Society. Vol. 65, Pg. 2091, 1943.