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Details

Stereochemistry ACHIRAL
Molecular Formula C10H9F2N4O
Molecular Weight 239.2015
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of 4-Amino-1-(2-(2,4-difluorophenyl)-2-oxoethyl)-1H-1,2,4-triazol-4-ium

SMILES

N[N+]1=CN(CC(=O)C2=C(F)C=C(F)C=C2)N=C1

InChI

InChIKey=GJKAVPCLRNAVPH-UHFFFAOYSA-N
InChI=1S/C10H9F2N4O/c11-7-1-2-8(9(12)3-7)10(17)4-16-6-15(13)5-14-16/h1-3,5-6H,4,13H2/q+1

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
4-Amino-1-(2-(2,4-difluorophenyl)-2-oxoethyl)-1H-1,2,4-triazol-4-ium
Systematic Name English
1H-1,2,4-Triazolium, 4-amino-1-[2-(2,4-difluorophenyl)-2-oxoethyl]-
Systematic Name English
4H-1,2,4-Triazolium, 4-amino-1-[2-(2,4-difluorophenyl)-2-oxoethyl]-
Systematic Name English
4-Amino-1-[2-(2,4-difluorophenyl)-2-oxoethyl]-4H-1,2,4-triazolium
Systematic Name English
Code System Code Type Description
PUBCHEM
10401150
Created by admin on Sat Dec 16 19:50:14 GMT 2023 , Edited by admin on Sat Dec 16 19:50:14 GMT 2023
PRIMARY
CAS
755726-67-1
Created by admin on Sat Dec 16 19:50:13 GMT 2023 , Edited by admin on Sat Dec 16 19:50:13 GMT 2023
PRIMARY
FDA UNII
554G5QF25B
Created by admin on Sat Dec 16 19:50:13 GMT 2023 , Edited by admin on Sat Dec 16 19:50:13 GMT 2023
PRIMARY
NIH
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