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Substance Name: 3-Thiophenecarboxylic acid, 2-(benzoylamino)-4-phenyl-, 2-(dimethylamino)ethyl ester, monohydrochloride
RN: 78033-92-8
InChIKey: HBNQQXJHTXPGNU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H22-N2-O3-S.Cl-H

Molecular Weight

  • 430.9537
 
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Names and Synonyms

Synonym

  • 2-(Benzoylamino)-4-phenyl-3-thiophenecarboxylic acid 2-(dimethylamino)ethyl ester HCl

Systematic Name

  • 3-Thiophenecarboxylic acid, 2-(benzoylamino)-4-phenyl-, 2-(dimethylamino)ethyl ester, monohydrochloride

Registry Numbers

CAS Registry Number

  • 78033-92-8

System Generated Number

  • 0078033928

Molecular Formulas

Molecular Formula

  • C22-H22-N2-O3-S.Cl-H

Molecular Formula Fragments

  • C22-H22-N2-O3-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H22N2O3S.ClH/c1-24(2)13-14-27-22(26)19-18(16-9-5-3-6-10-16)15-28-21(19)23-20(25)17-11-7-4-8-12-17;/h3-12,15H,13-14H2,1-2H3,(H,23,25);1H

InChIKey

HBNQQXJHTXPGNU-UHFFFAOYSA-N

Smiles

CN(C)CCOC(=O)c1c(csc1NC(=O)c2ccccc2)c3ccccc3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intraperitoneal 500mg/kg (500mg/kg)   Pharmaceutical Chemistry Journal Vol. 14, Pg. 861, 1980.