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Substance Name: 1H-Pyrrole-3-carboxamide, 2,5-dihydro-N-(3-((2-(2-methoxy-4-(1-propenyl)phenoxy)-1-oxoethyl)amino)-2,2-dimethylpropyl)-2,2,5,5-tetramethyl-, hydrochloride
RN: 102150-77-6
InChIKey: GMAUMIYHAAHDPV-RRABGKBLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C26-H39-N3-O4.Cl-H

Molecular Weight

  • 494.072
 
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Names and Synonyms

  • 1H-Pyrrole-3-carboxamide, 2,5-dihydro-N-(3-((2-(2-methoxy-4-(1-propenyl)phenoxy)-1-oxoethyl)amino)-2,2-dimethylpropyl)-2,2,5,5-tetramethyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 102150-77-6

System Generated Number

  • 0102150776

Molecular Formulas

Molecular Formula

  • C26-H39-N3-O4.Cl-H

Molecular Formula Fragments

  • C26-H39-N3-O4
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C26H39N3O4.ClH/c1-9-10-18-11-12-20(21(13-18)32-8)33-15-22(30)27-16-24(2,3)17-28-23(31)19-14-25(4,5)29-26(19,6)7;/h9-14,29H,15-17H2,1-8H3,(H,27,30)(H,28,31);1H/b10-9+;

InChIKey

GMAUMIYHAAHDPV-RRABGKBLSA-N

Smiles

C/C=C/c1ccc(c(c1)OC)OCC(=O)NCC(C)(C)CNC(=O)C2=CC(NC2(C)C)(C)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 31mg/kg (31mg/kg)   Journal of Medicinal Chemistry. Vol. 29, Pg. 1138, 1986.