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Substance Name: Methanesulfonanilide, 4'-(2,3-dihydroxypropoxy)-3'-methoxy-, hydrochloride
RN: 63286-84-0
InChIKey: LTSGAEDKSDFJHR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H25-N3-O6-S.Cl-H

Molecular Weight

  • 520.0034
 
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Names and Synonyms

Synonym

  • 4'-(2,3-Dihydroxypropoxy)-3'-methoxymethanesulfonanilide hydrochloride

Systematic Name

  • Methanesulfonanilide, 4'-(2,3-dihydroxypropoxy)-3'-methoxy-, hydrochloride

Registry Numbers

CAS Registry Number

  • 63286-84-0

System Generated Number

  • 0063286840

Molecular Formulas

Molecular Formula

  • C24-H25-N3-O6-S.Cl-H

Molecular Formula Fragments

  • C24-H25-N3-O6-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H25N3O6S.ClH/c1-32-22-12-15(27-34(2,30)31)10-11-20(22)26-23-17-6-3-4-8-19(17)25-24-18(23)7-5-9-21(24)33-14-16(29)13-28;/h3-12,16,27-29H,13-14H2,1-2H3,(H,25,26);1H

InChIKey

LTSGAEDKSDFJHR-UHFFFAOYSA-N

Smiles

COc1cc(ccc1Nc2c3ccccc3nc4c2cccc4OCC(CO)O)NS(=O)(=O)C.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 23mg/kg (23mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 1453, 1979.