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Substance Name: 1-Heptanesulfonanilide, 4'-(9-acridinylamino)-3'-methoxy-, methanesulfonate
RN: 71798-52-2
InChIKey: UZQZSIWHDBCSIY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H31-N3-O3-S.C-H4-O3-S

Molecular Weight

  • 573.732
 
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Names and Synonyms

Synonym

  • 4'-(9-Acridinylamino)-3'-methoxy-1-heptanesulfonanilide methanesulfonate

Systematic Name

  • 1-Heptanesulfonanilide, 4'-(9-acridinylamino)-3'-methoxy-, methanesulfonate

Registry Numbers

CAS Registry Number

  • 71798-52-2

System Generated Number

  • 0071798522

Molecular Formulas

Molecular Formula

  • C27-H31-N3-O3-S.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C27-H31-N3-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C27H31N3O3S.CH4O3S/c1-3-4-5-6-11-18-34(31,32)30-20-16-17-25(26(19-20)33-2)29-27-21-12-7-9-14-23(21)28-24-15-10-8-13-22(24)27;1-5(2,3)4/h7-10,12-17,19,30H,3-6,11,18H2,1-2H3,(H,28,29);1H3,(H,2,3,4)

InChIKey

UZQZSIWHDBCSIY-UHFFFAOYSA-N

Smiles

c1(c2c(nc3ccccc13)cccc2)[NH+]c1c(cc(NS(CCCCCCC)(=O)=O)cc1)OC.S(C)(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 85mg/kg (85mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 1453, 1979.