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Substance Name: Barbituric acid, 5-(2-(diethylamino)ethyl)-1-(p-methoxyphenyl)-2-thio-
RN: 93725-49-6
InChIKey: LJXYGPNRIBHKMM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H23-N3-O3-S

Molecular Weight

  • 349.453
 
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Names and Synonyms

Synonyms

  • 5-(2-(Diethylamino)ethyl)-1-(p-methoxyphenyl)-2-thiobarbituric acid
  • 5-25-16-00098 (Beilstein Handbook Reference)
  • BRN 0932539

Systematic Name

  • Barbituric acid, 5-(2-(diethylamino)ethyl)-1-(p-methoxyphenyl)-2-thio-

Registry Numbers

CAS Registry Number

  • 93725-49-6

System Generated Number

  • 0093725496

Structure Descriptors

InChI

1S/C17H23N3O3S/c1-4-19(5-2)11-10-14-15(21)18-17(24)20(16(14)22)12-6-8-13(23-3)9-7-12/h6-9,14H,4-5,10-11H2,1-3H3,(H,18,21,24)

InChIKey

LJXYGPNRIBHKMM-UHFFFAOYSA-N

Smiles

N1(c2ccc(OC)cc2)C([C@@H](C(=O)NC1=S)CCN(CC)CC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 800mg/kg (800mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 82, Pg. 976, 1962.