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Details

Stereochemistry ACHIRAL
Molecular Formula C15H15FN4O
Molecular Weight 286.3048
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,4-TRIAZOLO(4,3-B)PYRIDAZIN-6(5H)-ONE, 7-(1,1-DIMETHYLETHYL)-3-(2-FLUOROPHENYL)-

SMILES

CC(C)(C)c1cc2nnc(-c3ccccc3F)n2nc1O

InChI

InChIKey=DBZJAHGIRBOYLI-UHFFFAOYSA-N
InChI=1S/C15H15FN4O/c1-15(2,3)10-8-12-17-18-13(20(12)19-14(10)21)9-6-4-5-7-11(9)16/h4-8H,1-3H3,(H,19,21)

HIDE SMILES / InChI

Molecular Formula C15H15FN4O
Molecular Weight 286.3048
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 14:27:39 UTC 2021
Edited
by admin
on Sat Jun 26 14:27:39 UTC 2021
Record UNII
O1H5QP7RNB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2,4-TRIAZOLO(4,3-B)PYRIDAZIN-6(5H)-ONE, 7-(1,1-DIMETHYLETHYL)-3-(2-FLUOROPHENYL)-
Systematic Name English
7-(1,1-DIMETHYLETHYL)-3-(2-FLUOROPHENYL)-1,2,4-TRIAZOLO(4,3-B)PYRIDAZIN-6(5H)-ONE
Systematic Name English
TPA023 METABOLITE M14
Common Name English
Code System Code Type Description
FDA UNII
O1H5QP7RNB
Created by admin on Sat Jun 26 14:27:39 UTC 2021 , Edited by admin on Sat Jun 26 14:27:39 UTC 2021
PRIMARY
PUBCHEM
21363522
Created by admin on Sat Jun 26 14:27:39 UTC 2021 , Edited by admin on Sat Jun 26 14:27:39 UTC 2021
PRIMARY
CAS
252977-56-3
Created by admin on Sat Jun 26 14:27:39 UTC 2021 , Edited by admin on Sat Jun 26 14:27:39 UTC 2021
PRIMARY
Related Record Type Details
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