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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H11F2N3O
Molecular Weight 251.232
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-((2-(2,4-DIFLUOROPHENYL)-3-METHYLOXIRAN-2-YL)METHYL)-1H-1,2,4-TRIAZOLE, (2R-CIS)-

SMILES

C[C@@H]1O[C@@]1(CN2C=NC=N2)C3=C(F)C=C(F)C=C3

InChI

InChIKey=QANJLSHZDUOBBP-QPUJVOFHSA-N
InChI=1S/C12H11F2N3O/c1-8-12(18-8,5-17-7-15-6-16-17)10-3-2-9(13)4-11(10)14/h2-4,6-8H,5H2,1H3/t8-,12+/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H11F2N3O
Molecular Weight 251.232
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 15:22:14 GMT 2023
Edited
by admin
on Sat Dec 16 15:22:14 GMT 2023
Record UNII
D1JO8189W7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-((2-(2,4-DIFLUOROPHENYL)-3-METHYLOXIRAN-2-YL)METHYL)-1H-1,2,4-TRIAZOLE, (2R-CIS)-
Systematic Name English
1H-1,2,4-TRIAZOLE, 1-((2-(2,4-DIFLUOROPHENYL)-3-METHYLOXIRANYL)METHYL)-, (2R-CIS)-
Systematic Name English
1H-1,2,4-TRIAZOLE, 1-(((2R,3S)-2-(2,4-DIFLUOROPHENYL)-3-METHYLOXIRANYL)METHYL)-
Systematic Name English
1-(((2R,3S)-2-(2,4-DIFLUOROPHENYL)-3-METHYLOXIRAN-2-YL)METHYL)-1H-1,2,4-TRIAZOLE
Systematic Name English
Code System Code Type Description
FDA UNII
D1JO8189W7
Created by admin on Sat Dec 16 15:22:14 GMT 2023 , Edited by admin on Sat Dec 16 15:22:14 GMT 2023
PRIMARY
PUBCHEM
10131191
Created by admin on Sat Dec 16 15:22:14 GMT 2023 , Edited by admin on Sat Dec 16 15:22:14 GMT 2023
PRIMARY
CAS
127000-90-2
Created by admin on Sat Dec 16 15:22:14 GMT 2023 , Edited by admin on Sat Dec 16 15:22:14 GMT 2023
PRIMARY