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

Details

Stereochemistry ACHIRAL
Molecular Formula C24H21ClN6O3S2.CH4O3S
Molecular Weight 637.151
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PF-05150122 Mesylate

SMILES

CS(O)(=O)=O.CCN1CC(C1)N2N=CC=C2C3=C(OC4=CC=C(C=C4C#N)S(=O)(=O)NC5=CSC=N5)C=CC(Cl)=C3

InChI

InChIKey=RPSAKQTWUJBANX-UHFFFAOYSA-N
InChI=1S/C24H21ClN6O3S2.CH4O3S/c1-2-30-12-18(13-30)31-21(7-8-28-31)20-10-17(25)3-5-23(20)34-22-6-4-19(9-16(22)11-26)36(32,33)29-24-14-35-15-27-24;1-5(2,3)4/h3-10,14-15,18,29H,2,12-13H2,1H3;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 C24H21ClN6O3S2
Molecular Weight 541.045
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 19:44:12 GMT 2025
Edited
by admin
on Wed Apr 02 19:44:12 GMT 2025
Record UNII
S5U9EQ8LSP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PF-05150122 Mesylate
Preferred Name English
Code System Code Type Description
PUBCHEM
171390190
Created by admin on Wed Apr 02 19:44:12 GMT 2025 , Edited by admin on Wed Apr 02 19:44:12 GMT 2025
PRIMARY
FDA UNII
S5U9EQ8LSP
Created by admin on Wed Apr 02 19:44:12 GMT 2025 , Edited by admin on Wed Apr 02 19:44:12 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY