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Details

Stereochemistry RACEMIC
Molecular Formula C10H9F2N3O
Molecular Weight 225.1948
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-((6RS)-4,6-DIFLUORO-6-(1H-1,2,4-TRIAZOL-1-YL)CYCLOHEXA-1,4-DIEN-1-YL)ETHANONE

SMILES

CC(=O)C1=CCC(F)=CC1(F)N2C=NC=N2

InChI

InChIKey=QVNUEMDLWMCXAX-UHFFFAOYSA-N
InChI=1S/C10H9F2N3O/c1-7(16)9-3-2-8(11)4-10(9,12)15-6-13-5-14-15/h3-6H,2H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
1-((6RS)-4,6-DIFLUORO-6-(1H-1,2,4-TRIAZOL-1-YL)CYCLOHEXA-1,4-DIEN-1-YL)ETHANONE
Systematic Name English
FLUCONAZOLE IMPURITY E [WHO-IP]
Preferred Name English
ETHANONE, 1-(4,6-DIFLUORO-6-(1H-1,2,4-TRIAZOL-1-YL)-1,4-CYCLOHEXADIEN-1-YL)-
Systematic Name English
Code System Code Type Description
PUBCHEM
154572902
Created by admin on Tue Apr 01 16:20:31 GMT 2025 , Edited by admin on Tue Apr 01 16:20:31 GMT 2025
PRIMARY
CAS
1174406-04-2
Created by admin on Tue Apr 01 16:20:31 GMT 2025 , Edited by admin on Tue Apr 01 16:20:31 GMT 2025
PRIMARY
FDA UNII
69J0YN9VL8
Created by admin on Tue Apr 01 16:20:31 GMT 2025 , Edited by admin on Tue Apr 01 16:20:31 GMT 2025
PRIMARY
NIH
NCATS
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