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Details

Stereochemistry ACHIRAL
Molecular Formula C11H9F2N3O2
Molecular Weight 253.2049
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of CGP-47292 METHYL ESTER

SMILES

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

InChI

InChIKey=XVEURJOWGBWEPY-UHFFFAOYSA-N
InChI=1S/C11H9F2N3O2/c1-18-11(17)10-6-16(15-14-10)5-7-8(12)3-2-4-9(7)13/h2-4,6H,5H2,1H3

HIDE SMILES / InChI

Molecular Formula C11H9F2N3O2
Molecular Weight 253.2049
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:17:25 UTC 2023
Edited
by admin
on Sat Dec 16 09:17:25 UTC 2023
Record UNII
6K1724ZSGB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CGP-47292 METHYL ESTER
Common Name English
METHYL 1-(2,6-DIFLUOROBENZYL)-1H -1,2,3-TRIAZOLE-4-CARBOXYLATE
Systematic Name English
RUFINAMIDE RELATED COMPOUND B [USP-RS]
Common Name English
1H-1,2,3-TRIAZOLE-4-CARBOXYLIC ACID, 1-((2,6-DIFLUOROPHENYL)METHYL)-, METHYL ESTER
Systematic Name English
RUFINAMIDE RELATED COMPOUND B
USP   USP-RS  
Common Name English
RUFINAMIDE RELATED COMPOUND B [USP IMPURITY]
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID90176142
Created by admin on Sat Dec 16 09:17:25 UTC 2023 , Edited by admin on Sat Dec 16 09:17:25 UTC 2023
PRIMARY
RS_ITEM_NUM
1606423
Created by admin on Sat Dec 16 09:17:25 UTC 2023 , Edited by admin on Sat Dec 16 09:17:25 UTC 2023
PRIMARY
CAS
217448-86-7
Created by admin on Sat Dec 16 09:17:25 UTC 2023 , Edited by admin on Sat Dec 16 09:17:25 UTC 2023
PRIMARY
PUBCHEM
22716778
Created by admin on Sat Dec 16 09:17:25 UTC 2023 , Edited by admin on Sat Dec 16 09:17:25 UTC 2023
PRIMARY
FDA UNII
6K1724ZSGB
Created by admin on Sat Dec 16 09:17:25 UTC 2023 , Edited by admin on Sat Dec 16 09:17:25 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP