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Substance Name: NSC 221153
RN: 74050-92-3
InChIKey: ZZMNCIGGPDIGKP-UHFFFAOYSA-N

Molecular Formula

  • C39-H40-N20-O2

Molecular Weight

  • 820.883
 
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Names and Synonyms

Results Name

  • NSC 221153

Synonyms

  • 4-22-00-03259 (Beilstein Handbook Reference)
  • BRN 0383415
  • NSC 221153

Systematic Names

  • 2,6-Pyridinedicarboxamide, 1,4-dihydro-4-(3-phenylamidinoamidinoimino)-N,N,1-tris(phenylamidinoamidino)-
  • 2,6-Pyridinedicarboxamide, 1,4-dihydro-N,N',1-tris(imino((imino(phenylamino)methyl)amino)methyl)-4-((imino((imino(phenylamino)methyl)amino)methyl)imino)-(9CI)

Registry Numbers

CAS Registry Number

  • 74050-92-3

System Generated Number

  • 0074050923

Structure Descriptors

InChI

1S/C39H40N20O2/c40-32(48-23-13-5-1-6-14-23)55-35(43)52-27-21-28(30(60)53-37(45)56-33(41)49-24-15-7-2-8-16-24)59(39(47)58-36(44)51-26-19-11-4-12-20-26)29(22-27)31(61)54-38(46)57-34(42)50-25-17-9-3-10-18-25/h1-22H,(H4,40,43,48,55)(H4,44,47,51,58)(H5,41,45,49,53,56,60)(H5,42,46,50,54,57,61)

InChIKey

ZZMNCIGGPDIGKP-UHFFFAOYSA-N

Smiles

n1(c(C(NC(NC(Nc2ccccc2)=N)=N)=O)cc(\cc1C(NC(NC(Nc1ccccc1)=N)=N)=O)=N\C(NC(Nc1ccccc1)=N)=N)C(NC(Nc1ccccc1)=N)=N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01976,