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Substance Name: CGP-68730A free acid
RN: 177537-85-8
UNII: OON9CY277Y
InChIKey: XXVWUDSZHNDHAU-ZCFIWIBFSA-N

Molecular Formula

  • C12-H9-Br-N2-O4-S

Molecular Weight

  • 357.1831
 
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Names and Synonyms

Name of Substance

  • CGP-68730A free acid

Synonyms

  • (-)-Cgp-68730a free acid
  • 5H-Pyrazino(1,2,3-de)-1,4-benzothiazine-3-acetic acid, 9-bromo-2,3,6,7-tetrahydro-5,6-dioxo-, (3R)-
  • 5H-Pyrazino(1,2,3-de)-1,4-benzothiazine-3-acetic acid, 9-bromo-2,3,6,7-tetrahydro-5,6-dioxo-, (R)-
  • CGP-68730A free acid
  • UNII-OON9CY277Y

Registry Numbers

CAS Registry Number

  • 177537-85-8

FDA UNII

  • OON9CY277Y

System Generated Number

  • 0177537858

Structure Descriptors

InChI

InChI=1S/C12H9BrN2O4S/c13-5-1-7-10-8(2-5)20-4-6(3-9(16)17)15(10)12(19)11(18)14-7/h1-2,6H,3-4H2,(H,14,18)(H,16,17)/t6-/m1/s1

InChIKey

XXVWUDSZHNDHAU-ZCFIWIBFSA-N

Smiles

OC(=O)C[C@@H]1CSc2cc(Br)cc3NC(=O)C(=O)N1c23