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Details

Stereochemistry ACHIRAL
Molecular Formula C24H19F4N7O.CH4O3S
Molecular Weight 593.553
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Pebezertinib mesylate

SMILES

CS(O)(=O)=O.CN1C=C(NC2=NC=C(C3=CC=C(C=C3)C(F)(F)F)C(NC4=C(F)C=CC(NC(=O)C=C)=C4)=N2)C=N1

InChI

InChIKey=GPZFYPQOIZYNNM-UHFFFAOYSA-N
InChI=1S/C24H19F4N7O.CH4O3S/c1-3-21(36)31-16-8-9-19(25)20(10-16)33-22-18(14-4-6-15(7-5-14)24(26,27)28)12-29-23(34-22)32-17-11-30-35(2)13-17;1-5(2,3)4/h3-13H,1H2,2H3,(H,31,36)(H2,29,32,33,34);1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula CH4O3S
Molecular Weight 96.106
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C24H19F4N7O
Molecular Weight 497.4476
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 Wed Apr 02 12:25:52 GMT 2025
Edited
by admin
on Wed Apr 02 12:25:52 GMT 2025
Record UNII
D58TYV6BB4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Pebezertinib mesylate
Common Name English
BLU-203139 mesylate
Preferred Name English
BLU-451 MESYLATE
Code English
BLU203139 mesylate
Code English
Code System Code Type Description
FDA UNII
D58TYV6BB4
Created by admin on Wed Apr 02 12:25:52 GMT 2025 , Edited by admin on Wed Apr 02 12:25:52 GMT 2025
PRIMARY
PUBCHEM
171390008
Created by admin on Wed Apr 02 12:25:52 GMT 2025 , Edited by admin on Wed Apr 02 12:25:52 GMT 2025
PRIMARY
CAS
3006000-84-3
Created by admin on Wed Apr 02 12:25:52 GMT 2025 , Edited by admin on Wed Apr 02 12:25:52 GMT 2025
PRIMARY
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