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Substance Name: 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-(4-nitrophenyl)ethyl)-5-(1-oxopropoxy)-
RN: 37431-54-2
InChIKey: MYCZXPNRUULRDV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H15-N3-O7

Molecular Weight

  • 349.2975
 
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Names and Synonyms

Synonyms

  • 5-(1-(4-Nitrophenyl)ethyl)-5-(1-oxopropoxy)-2,4,6(1H,3H,5H)-pyrimidinetrione
  • 5-25-03-00338 (Beilstein Handbook Reference)
  • 5-Propionoxy-5-(1-p-nitrophenylethyl)barbituric acid
  • BRN 0768948

Systematic Name

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-(4-nitrophenyl)ethyl)-5-(1-oxopropoxy)-

Registry Numbers

CAS Registry Number

  • 37431-54-2

System Generated Number

  • 0037431542

Structure Descriptors

InChI

1S/C15H15N3O7/c1-3-11(19)25-15(12(20)16-14(22)17-13(15)21)8(2)9-4-6-10(7-5-9)18(23)24/h4-8H,3H2,1-2H3,(H2,16,17,20,21,22)

InChIKey

MYCZXPNRUULRDV-UHFFFAOYSA-N

Smiles

CCC(=O)OC1(C(=O)NC(=O)NC1=O)C(C)c2ccc(cc2)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 500mg/kg (500mg/kg) BEHAVIORAL: ANALGESIA Journal of Medicinal Chemistry. Vol. 17, Pg. 732, 1974.