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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H7F2N3O2
Molecular Weight 239.1783
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CGP-47292

SMILES

OC(=O)C1=CN(CC2=C(F)C=CC=C2F)N=N1

InChI

InChIKey=OPJHWTKDQYKYHL-UHFFFAOYSA-N
InChI=1S/C10H7F2N3O2/c11-7-2-1-3-8(12)6(7)4-15-5-9(10(16)17)13-14-15/h1-3,5H,4H2,(H,16,17)

HIDE SMILES / InChI

Molecular Formula C10H7F2N3O2
Molecular Weight 239.1783
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:17:24 UTC 2023
Edited
by admin
on Sat Dec 16 09:17:24 UTC 2023
Record UNII
266244C47B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CGP-47292
Common Name English
1-(2,6-DIFLUOROBENZYL)-1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID
Systematic Name English
1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID, 1-((2,6-DIFLUOROPHENYL)METHYL)-
Systematic Name English
RUFINAMIDE METABOLITE P2
Common Name English
Code System Code Type Description
CAS
166196-11-8
Created by admin on Sat Dec 16 09:17:24 UTC 2023 , Edited by admin on Sat Dec 16 09:17:24 UTC 2023
PRIMARY
PUBCHEM
10014469
Created by admin on Sat Dec 16 09:17:24 UTC 2023 , Edited by admin on Sat Dec 16 09:17:24 UTC 2023
PRIMARY
EPA CompTox
DTXSID70168080
Created by admin on Sat Dec 16 09:17:24 UTC 2023 , Edited by admin on Sat Dec 16 09:17:24 UTC 2023
PRIMARY
FDA UNII
266244C47B
Created by admin on Sat Dec 16 09:17:24 UTC 2023 , Edited by admin on Sat Dec 16 09:17:24 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
MAJOR
URINE
PARENT -> METABOLITE
MAJOR
PLASMA
PARENT -> METABOLITE
FECAL