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Details

Stereochemistry ACHIRAL
Molecular Formula C15H15FN4O
Molecular Weight 286.3042
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

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

SMILES

CC(C)(C)C1=CC2=NN=C(N2NC1=O)C3=CC=CC=C3F

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

Approval Year

Unknown
139594
Name Type Language
7-(1,1-DIMETHYLETHYL)-3-(2-FLUOROPHENYL)-1,2,4-TRIAZOLO(4,3-B)PYRIDAZIN-6(5H)-ONE
Systematic Name English
1,2,4-TRIAZOLO(4,3-B)PYRIDAZIN-6(5H)-ONE, 7-(1,1-DIMETHYLETHYL)-3-(2-FLUOROPHENYL)-
Systematic Name English
TPA023 METABOLITE M14
Common Name English
Code System Code Type Description
FDA UNII
O1H5QP7RNB
Created by admin on Sat Dec 16 16:10:24 GMT 2023 , Edited by admin on Sat Dec 16 16:10:24 GMT 2023
PRIMARY
PUBCHEM
21363522
Created by admin on Sat Dec 16 16:10:24 GMT 2023 , Edited by admin on Sat Dec 16 16:10:24 GMT 2023
PRIMARY
CAS
252977-56-3
Created by admin on Sat Dec 16 16:10:24 GMT 2023 , Edited by admin on Sat Dec 16 16:10:24 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of MK-0777
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