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Substance Name: Pentamidine mesylate
ID: CV65270000
InChIKey: LCNPURURRXMYET-UHFFFAOYSA-M

Classification Codes

  • Drug / Therapeutic Agent
  • Human Data

Molecular Formula

  • C19-H24-N4-O2.C-H4-O3-S

Molecular Weight

  • 435.5223
 
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Names and Synonyms

Results Name

  • Pentamidine mesylate

Synonyms

  • 4,4'-(Pentamethylenedioxy)dibenzamidine methanesulfonate
  • Pentamidine mesylate

Systematic Name

  • Benzamidine, 4,4'-(pentamethylenedioxy)di-, methanesulfonate

Registry Numbers

ID Number

  • NIOSH/CV6527000

System Generated Number

  • CV65270000

Molecular Formulas

Molecular Formula

  • C19-H24-N4-O2.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C19-H24-N4-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C19H24N4O2.CH4O3S/c20-18(21)14-4-8-16(9-5-14)24-12-2-1-3-13-25-17-10-6-15(7-11-17)19(22)23;1-5(2,3)4/h4-11H,1-3,12-13H2,(H3,20,21)(H3,22,23);1H3,(H,2,3,4)/p-1

InChIKey

LCNPURURRXMYET-UHFFFAOYSA-M

Smiles

CS(=O)(=O)[O-].NC(=N)c1ccc(OCCCCCOc2ccc(cc2)C(=N)N)cc1