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Substance Name: 1H-Pyrrole-3-carboxamide, 2,5-dihydro-N-(3-(((3-allyloxyphenyl)methyl)amino)propyl)-2,2,5,5-tetramethyl-, dihydrochloride
RN: 102131-99-7
InChIKey: WZZLGAYPWANNNZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H33-N3-O2.2Cl-H

Molecular Weight

  • 444.4435
 
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Names and Synonyms

  • 1H-Pyrrole-3-carboxamide, 2,5-dihydro-N-(3-(((3-allyloxyphenyl)methyl)amino)propyl)-2,2,5,5-tetramethyl-, dihydrochloride

Registry Numbers

CAS Registry Number

  • 102131-99-7

System Generated Number

  • 0102131997

Molecular Formulas

Molecular Formula

  • C22-H33-N3-O2.2Cl-H

Molecular Formula Fragments

  • C22-H33-N3-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H33N3O2.2ClH/c1-6-13-27-18-10-7-9-17(14-18)16-23-11-8-12-24-20(26)19-15-21(2,3)25-22(19,4)5;;/h6-7,9-10,14-15,23,25H,1,8,11-13,16H2,2-5H3,(H,24,26);2*1H

InChIKey

WZZLGAYPWANNNZ-UHFFFAOYSA-N

Smiles

CC1(C=C(C(N1)(C)C)C(=O)NCCCNCc2cccc(c2)OCC=C)C.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 34mg/kg (34mg/kg)   Journal of Medicinal Chemistry. Vol. 29, Pg. 1138, 1986.