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Substance Name: 1H-Pyrrole-3-carboxamide, 2,5-dihydro-N-(2-((2,6-dimethylphenyl)amino)-2-oxo-1-phenylethyl)-2,2,5,5-tetramethyl-, hydrochloride
RN: 102132-17-2
InChIKey: JLTCUFWFQQUYAO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C25-H31-N3-O2.Cl-H

Molecular Weight

  • 441.9998
 
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Names and Synonyms

  • 1H-Pyrrole-3-carboxamide, 2,5-dihydro-N-(2-((2,6-dimethylphenyl)amino)-2-oxo-1-phenylethyl)-2,2,5,5-tetramethyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 102132-17-2

System Generated Number

  • 0102132172

Molecular Formulas

Molecular Formula

  • C25-H31-N3-O2.Cl-H

Molecular Formula Fragments

  • C25-H31-N3-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C25H31N3O2.ClH/c1-16-11-10-12-17(2)20(16)26-23(30)21(18-13-8-7-9-14-18)27-22(29)19-15-24(3,4)28-25(19,5)6;/h7-15,21,28H,1-6H3,(H,26,30)(H,27,29);1H

InChIKey

JLTCUFWFQQUYAO-UHFFFAOYSA-N

Smiles

Cc1cccc(c1NC(=O)C(c2ccccc2)NC(=O)C3=CC(NC3(C)C)(C)C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 7600ug/kg (7.6mg/kg)   Journal of Medicinal Chemistry. Vol. 29, Pg. 1138, 1986.