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Substance Name: Nivocasan [USAN:INN]
RN: 908253-63-4
UNII: 9554OW6MVU
InChIKey: VYFGDLGHHBUDTQ-ZLGUVYLKSA-N

Classification Code

  • Apoptosis Prevention During Cell Stress

Molecular Formula

  • C21-H22-F-N3-O5

Molecular Weight

  • 415.4188
 
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Names and Synonyms

Name of Substance

  • Nivocasan [USAN:INN]

Synonyms

  • (5R)-N-((2S,3S)-2-(Fluoromethyl)-2-hydroxy-5-oxo-tetrahydrofuran-3-yl)-3-(isoquinolin- 1-yl)-5-(1-methylethyl)-4,5-dihydroisoxazole-5-carboxamide
  • GS 9450
  • GS-9450
  • LB 84451
  • LB84451
  • Nivocasan
  • UNII-9554OW6MVU

Systematic Name

  • 5-Isoxazolecarboxamide, N-((2S,3S)-2-(fluoromethyl)tetrahydro-2-hydroxy-5-oxo-3- furanyl)-4,5-dihydro-3-(1-isoquinolinyl)-5-(1-methylethyl)-, (5R)-

Registry Numbers

CAS Registry Number

  • 908253-63-4

FDA UNII

  • 9554OW6MVU

Other Registry Number

  • 1001913-20-7

System Generated Number

  • 0908253634

Structure Descriptors

InChI

1S/C21H22FN3O5/c1-12(2)20(19(27)24-16-9-17(26)29-21(16,28)11-22)10-15(25-30-20)18-14-6-4-3-5-13(14)7-8-23-18/h3-8,12,16,28H,9-11H2,1-2H3,(H,24,27)/t16-,20+,21+/m0/s1

InChIKey

VYFGDLGHHBUDTQ-ZLGUVYLKSA-N

Smiles

CC(C)[C@]1(CC(=NO1)c2c3ccccc3ccn2)C(=O)N[C@H]4CC(=O)O[C@@]4(CF)O