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Details

Stereochemistry ACHIRAL
Molecular Formula C21H21FN8O2
Molecular Weight 436.4422
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Ethyl 4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-pyrimidinyl(methyl)carbamate

SMILES

CCOC(=O)N(C)C1=C(N)N=C(N=C1N)C2=NN(CC3=CC=CC=C3F)C4=C2C=CC=N4

InChI

InChIKey=KRAWHPFLLSOTJI-UHFFFAOYSA-N
InChI=1S/C21H21FN8O2/c1-3-32-21(31)29(2)16-17(23)26-19(27-18(16)24)15-13-8-6-10-25-20(13)30(28-15)11-12-7-4-5-9-14(12)22/h4-10H,3,11H2,1-2H3,(H4,23,24,26,27)

HIDE SMILES / InChI

Approval Year

Name Type Language
Ethyl 4,6-diamino-2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-pyrimidinyl(methyl)carbamate
Systematic Name English
Carbamic acid, [4,6-diamino-2-[1-[(2-fluorophenyl)methyl]-1H-pyrazolo[3,4-b]pyridin-3-yl]-5-pyrimidinyl]methyl-, ethyl ester
Preferred Name English
Code System Code Type Description
CAS
625115-53-9
Created by admin on Wed Apr 02 17:45:57 GMT 2025 , Edited by admin on Wed Apr 02 17:45:57 GMT 2025
PRIMARY
PUBCHEM
21081986
Created by admin on Wed Apr 02 17:45:57 GMT 2025 , Edited by admin on Wed Apr 02 17:45:57 GMT 2025
PRIMARY
FDA UNII
4C3L5UK7C6
Created by admin on Wed Apr 02 17:45:57 GMT 2025 , Edited by admin on Wed Apr 02 17:45:57 GMT 2025
PRIMARY