U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C14H12FN5
Molecular Weight 269.277
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[(4-Fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridine-3-carboximidamide

SMILES

NC(=N)C1=NN(CC2=CC=C(F)C=C2)C3=NC=CC=C13

InChI

InChIKey=XWFNYIGCFVDCFN-UHFFFAOYSA-N
InChI=1S/C14H12FN5/c15-10-5-3-9(4-6-10)8-20-14-11(2-1-7-18-14)12(19-20)13(16)17/h1-7H,8H2,(H3,16,17)

HIDE SMILES / InChI

Molecular Formula C14H12FN5
Molecular Weight 269.277
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 Dec 16 20:11:28 GMT 2023
Edited
by admin
on Sat Dec 16 20:11:28 GMT 2023
Record UNII
PDR9M799U7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-[(4-Fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridine-3-carboximidamide
Systematic Name English
1H-Pyrazolo[3,4-b]pyridine-3-carboximidamide, 1-[(4-fluorophenyl)methyl]-
Systematic Name English
Code System Code Type Description
CAS
2512205-25-1
Created by admin on Sat Dec 16 20:11:28 GMT 2023 , Edited by admin on Sat Dec 16 20:11:28 GMT 2023
PRIMARY
FDA UNII
PDR9M799U7
Created by admin on Sat Dec 16 20:11:28 GMT 2023 , Edited by admin on Sat Dec 16 20:11:28 GMT 2023
PRIMARY