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Substance Name: Barbituric acid, 5-(2-(dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thio-
RN: 93150-46-0
InChIKey: QHCXQHKAWSHBOK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H21-N3-O3-S

Molecular Weight

  • 335.426
 
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Names and Synonyms

Synonyms

  • 5-(2-(Dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thiobarbituric acid
  • 5-25-16-00098 (Beilstein Handbook Reference)
  • BRN 0931214

Systematic Name

  • Barbituric acid, 5-(2-(dimethylamino)ethyl)-1-(p-ethoxyphenyl)-2-thio-

Registry Numbers

CAS Registry Number

  • 93150-46-0

System Generated Number

  • 0093150460

Structure Descriptors

InChI

1S/C16H21N3O3S/c1-4-22-12-7-5-11(6-8-12)19-15(21)13(9-10-18(2)3)14(20)17-16(19)23/h5-8,13H,4,9-10H2,1-3H3,(H,17,20,23)

InChIKey

QHCXQHKAWSHBOK-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 570mg/kg (570mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 82, Pg. 976, 1962.