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Substance Name: Iobenguane sulfate I 131 [USAN]
RN: 149210-33-3
UNII: M575VKV19N
InChIKey: XNACDNPGABUBFR-GNPGNDBSSA-N

Classification Codes

  • Diagnostic Aid
  • Radioactive Agent

Molecular Formula

  • C16-H20-I2-N6.H2-S-O4

Molecular Weight

  • 656.4538
 
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Names and Synonyms

Name of Substance

  • Iobenguane sulfate I 131 [USAN]

Synonyms

  • (m-((sup 131)I)Iodobenzyl)guanidine sulfate (2:1)
  • Guanidine, ((3-(iodo-(sup 131)I)phenyl)methyl)-, sulfate (2:1)
  • Iobenguane sulfate I 131
  • UNII-M575VKV19N

Systematic Name

  • Guanidine, ((3-(iodo-131I)phenyl)methyl)-, sulfate (2:1)

Registry Numbers

CAS Registry Number

  • 149210-33-3

FDA UNII

  • M575VKV19N

System Generated Number

  • 0149210333

Molecular Formulas

Molecular Formula

  • C16-H20-I2-N6.H2-S-O4

Molecular Formula Fragments

  • C16-H20-I2-N6
  • COMPONENT
  • H2-S-O4

Structure Descriptors

InChI

1S/2C8H10IN3.H2O4S/c2*9-7-3-1-2-6(4-7)5-12-8(10)11;1-5(2,3)4/h2*1-4H,5H2,(H4,10,11,12);(H2,1,2,3,4)/i2*9+4;

InChIKey

XNACDNPGABUBFR-GNPGNDBSSA-N

Smiles

c1cc(cc(c1)[131I])CNC(=N)N.c1cc(cc(c1)[131I])CNC(=N)N.OS(=O)(=O)O