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Substance Name: Barbituric acid, 5-(1-methyl-1-propenyl)-5-propyl-2-thio-
RN: 66843-07-0
InChIKey: MCVXYOWQRCYJEE-FNORWQNLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H16-N2-O2-S

Molecular Weight

  • 240.325
 
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Names and Synonyms

Synonyms

  • 4-24-00-02006 (Beilstein Handbook Reference)
  • 5-(1-Methyl-1-propenyl)-5-propyl-2-thiobarbituric acid
  • BRN 0202496

Systematic Name

  • Barbituric acid, 5-(1-methyl-1-propenyl)-5-propyl-2-thio-

Registry Numbers

CAS Registry Number

  • 66843-07-0

System Generated Number

  • 0066843070

Structure Descriptors

InChI

1S/C11H16N2O2S/c1-4-6-11(7(3)5-2)8(14)12-10(16)13-9(11)15/h5H,4,6H2,1-3H3,(H2,12,13,14,15,16)/b7-5+

InChIKey

MCVXYOWQRCYJEE-FNORWQNLSA-N

Smiles

C1(C(NC(=S)NC1=O)=O)(\C(=C\C)C)CCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 475mg/kg (475mg/kg)   Journal of the American Chemical Society. Vol. 61, Pg. 353, 1939.
mouse LD50 oral 540mg/kg (540mg/kg)   Journal of the American Chemical Society. Vol. 61, Pg. 353, 1939.