U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C15H11F6N5O2
Molecular Weight 407.2706
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Relutrigine

SMILES

CCOC(F)(F)C1=NN=C2C=NC(=CN12)C3=CN=C(OCC(F)(F)F)C(F)=C3

InChI

InChIKey=BFXBSYMVTNEFRF-UHFFFAOYSA-N
InChI=1S/C15H11F6N5O2/c1-2-28-15(20,21)13-25-24-11-5-22-10(6-26(11)13)8-3-9(16)12(23-4-8)27-7-14(17,18)19/h3-6H,2,7H2,1H3

HIDE SMILES / InChI

Molecular Formula C15H11F6N5O2
Molecular Weight 407.2706
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:57:57 GMT 2023
Edited
by admin
on Sat Dec 16 18:57:57 GMT 2023
Record UNII
AW5C5XHM4W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Relutrigine
INN  
Official Name English
1,2,4-TRIAZOLO(4,3-A)PYRAZINE, 3-(ETHOXYDIFLUOROMETHYL)-6-(5-FLUORO-6-(2,2,2-TRIFLUOROETHOXY)-3-PYRIDINYL)-
Systematic Name English
relutrigine [INN]
Common Name English
3-(ethoxydifluoromethyl)-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)pyridin-3- yl][1,2,4]triazolo[4,3-a]pyrazine
Systematic Name English
3-(ethoxydifluoromethyl)-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)pyridin-3- yl][1,2,4]triazolo[4,3-a]pyrazine
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 789620
Created by admin on Sat Dec 16 18:57:57 GMT 2023 , Edited by admin on Sat Dec 16 18:57:57 GMT 2023
FDA ORPHAN DRUG 789420
Created by admin on Sat Dec 16 18:57:57 GMT 2023 , Edited by admin on Sat Dec 16 18:57:57 GMT 2023
Code System Code Type Description
INN
12609
Created by admin on Sat Dec 16 18:57:57 GMT 2023 , Edited by admin on Sat Dec 16 18:57:57 GMT 2023
PRIMARY
CAS
2392951-29-8
Created by admin on Sat Dec 16 18:57:57 GMT 2023 , Edited by admin on Sat Dec 16 18:57:57 GMT 2023
PRIMARY
NCI_THESAURUS
C199101
Created by admin on Sat Dec 16 18:57:57 GMT 2023 , Edited by admin on Sat Dec 16 18:57:57 GMT 2023
PRIMARY
PUBCHEM
147075611
Created by admin on Sat Dec 16 18:57:57 GMT 2023 , Edited by admin on Sat Dec 16 18:57:57 GMT 2023
PRIMARY
FDA UNII
AW5C5XHM4W
Created by admin on Sat Dec 16 18:57:57 GMT 2023 , Edited by admin on Sat Dec 16 18:57:57 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY
PRAX-562 was tested in a range of in vitro, ex vivo, and in vivo nonclinical pharmacology assays to characterize its inhibition of a variety of NaV channels from human and relevant animal species