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Substance Name: ICI 207828
RN: 119778-11-9
InChIKey: OBRXFUXYWFFYJV-UHFFFAOYSA-N

Molecular Formula

  • C24-H36-Br-Cl-N8-O3

Molecular Weight

  • 599.958
 
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Names and Synonyms

Name of Substance

  • ICI 207828

Synonyms

  • Ici-207,828
  • N-(2-(3-Bromo-5-tert-butyl-2-hydroxybenzylamino)ethyl)-3-(N-2-(3,4-diamino-6-chloropyrazin-2-ylcarboxamido)ethyl)-N-methylaminopropionamide

Systematic Name

  • Pyrazinecarboxamide, 3,5-diamino-N-(2-((3-((2-(((3-bromo-5-(1,1-dimethylethyl)-2-hydroxyphenyl)methyl)amino)ethyl)amino)-3-oxopropyl)methylamino)ethyl)-6-chloro-

Registry Numbers

CAS Registry Number

  • 119778-11-9

System Generated Number

  • 0119778119

Structure Descriptors

InChI

1S/C24H36BrClN8O3/c1-24(2,3)15-11-14(19(36)16(25)12-15)13-29-6-7-30-17(35)5-9-34(4)10-8-31-23(37)18-21(27)33-22(28)20(26)32-18/h11-12,29,36H,5-10,13H2,1-4H3,(H,30,35)(H,31,37)(H4,27,28,33)

InChIKey

OBRXFUXYWFFYJV-UHFFFAOYSA-N

Smiles

c1(c(nc(c(n1)Cl)N)N)C(=O)NCC[N@@](C)CCC(=O)NCCNCc1c(c(cc(c1)C(C)(C)C)Br)O