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Substance Name: Acetamide, N-(9-(4-(hexylsulfonamido)anilino)acridin-3-yl)-, methanesulfonate
RN: 53222-06-3
InChIKey: QGGUOGWJVQPOFV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C27-H29-N4-O3-S.C-H3-O3-S

Molecular Weight

  • 586.731
 
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Names and Synonyms

Synonym

  • N-(9-(4-(Hexylsulfonamido)anilino)acridin-3-yl)acetamide methanesulfonate

Systematic Name

  • Acetamide, N-(9-(4-(hexylsulfonamido)anilino)acridin-3-yl)-, methanesulfonate

Registry Numbers

CAS Registry Number

  • 53222-06-3

System Generated Number

  • 0053222063

Molecular Formulas

Molecular Formula

  • C27-H29-N4-O3-S.C-H3-O3-S

Molecular Formula Fragments

  • C-H3-O3-S
  • C27-H29-N4-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C27H30N4O3S.CH4O3S/c1-3-4-5-8-17-35(33,34)31-21-13-11-20(12-14-21)29-27-23-9-6-7-10-25(23)30-26-18-22(28-19(2)32)15-16-24(26)27;1-5(2,3)4/h6-7,9-16,18,31H,3-5,8,17H2,1-2H3,(H,28,32)(H,29,30);1H3,(H,2,3,4)

InChIKey

QGGUOGWJVQPOFV-UHFFFAOYSA-N

Smiles

c12c(c3c(cccc3)nc1cc(NC(C)=O)cc2)[NH+]c1ccc(NS(CCCCCC)(=O)=O)cc1.S(C)(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 21mg/kg (21mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 251, 1979.