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Substance Name: 1-Pentanesulfonanilide, 4'-(4-butylcarbamoyl-9-acridinylamino)-3'-methoxy-, hydrochloride, hydrate
RN: 71803-09-3
InChIKey: ILNRPKVGJZXPQX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H36-N4-O4-S.Cl-H.H2-O

Molecular Weight

  • 585.1653
 
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Names and Synonyms

Synonyms

  • 4'-(4-Butylcarbamoyl-9-acridinylamino)-3'-methoxy-1-pentanesulfonanilide HCl hydrate
  • 4-Acridinecarboxamide, N-butyl-9-(4-(pentylsulfonamido)-2-methoxyanilino)-, monohydrochloride

Systematic Name

  • 1-Pentanesulfonanilide, 4'-(4-butylcarbamoyl-9-acridinylamino)-3'-methoxy-, hydrochloride, hydrate

Registry Numbers

CAS Registry Number

  • 71803-09-3

System Generated Number

  • 0071803093

Molecular Formulas

Molecular Formula

  • C30-H36-N4-O4-S.Cl-H.H2-O

Molecular Formula Fragments

  • C30-H36-N4-O4-S
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C30H36N4O4S.ClH/c1-4-6-10-19-39(36,37)34-21-16-17-26(27(20-21)38-3)33-28-22-12-8-9-15-25(22)32-29-23(28)13-11-14-24(29)30(35)31-18-7-5-2;/h8-9,11-17,20,34H,4-7,10,18-19H2,1-3H3,(H,31,35)(H,32,33);1H

InChIKey

ILNRPKVGJZXPQX-UHFFFAOYSA-N

Smiles

CCCCCS(=O)(=O)Nc1ccc(c(c1)OC)Nc2c3ccccc3nc4c2cccc4C(=O)NCCCC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 300mg/kg (300mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 1453, 1979.