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Substance Name: Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl-
RN: 73680-99-6
InChIKey: DJYKVVADYPSQRV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H20-N2-O3

Molecular Weight

  • 348.4
 
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Names and Synonyms

Synonyms

  • 5-(3,3-Dimethylallyl)-1,3-diphenylbarbituric acid
  • 5-24-09-00221 (Beilstein Handbook Reference)
  • BRN 0566053

Systematic Name

  • Barbituric acid, 5-(3,3-dimethylallyl)-1,3-diphenyl-

Registry Numbers

CAS Registry Number

  • 73680-99-6

System Generated Number

  • 0073680996

Structure Descriptors

InChI

1S/C21H20N2O3/c1-15(2)13-14-18-19(24)22(16-9-5-3-6-10-16)21(26)23(20(18)25)17-11-7-4-8-12-17/h3-13,18H,14H2,1-2H3

InChIKey

DJYKVVADYPSQRV-UHFFFAOYSA-N

Smiles

N1(C(N(c2ccccc2)C(=O)C(C1=O)C\C=C(\C)C)=O)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 500mg/kg (500mg/kg)   Journal of Medicinal Chemistry. Vol. 7, Pg. 342, 1964.