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Substance Name: Urea, N-(imino(propylamino)methyl)-N'-(4-(trifluoromethyl)phenyl)-, monohydrochloride
RN: 68656-56-4
InChIKey: WNMAHFMPWLBMEX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H15-F3-N4-O.Cl-H

Molecular Weight

  • 324.7324
 
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Names and Synonyms

Synonyms

  • N-(Imino(propylamino)methyl)-N'-(4-(trifluoromethyl)phenyl)-urea hydrochloride
  • Urea, 1-propylamidino-3-(alpha,alpha,alpha-trifluoro-p-tolyl)-, hydrochloride

Systematic Name

  • Urea, N-(imino(propylamino)methyl)-N'-(4-(trifluoromethyl)phenyl)-, monohydrochloride

Registry Numbers

CAS Registry Number

  • 68656-56-4

System Generated Number

  • 0068656564

Molecular Formulas

Molecular Formula

  • C12-H15-F3-N4-O.Cl-H

Molecular Formula Fragments

  • C12-H15-F3-N4-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C12H15F3N4O.ClH/c1-2-7-17-10(16)19-11(20)18-9-5-3-8(4-6-9)12(13,14)15;/h3-6H,2,7H2,1H3,(H4,16,17,18,19,20);1H

InChIKey

WNMAHFMPWLBMEX-UHFFFAOYSA-N

Smiles

CCCNC(=N)NC(=O)Nc1ccc(cc1)C(F)(F)F.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 300mg/kg (300mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 28, Pg. 1435, 1978.