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Details

Stereochemistry ABSOLUTE
Molecular Formula C14H19N5O5S
Molecular Weight 369.396
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PF-07095462

SMILES

CN([C@@H]1C[C@@H](C1)NS(=O)(=O)CCC(O)=O)C2=NC=NC3=C2CC(=O)N3

InChI

InChIKey=IKTRQMLZSKIGET-DTORHVGOSA-N
InChI=1S/C14H19N5O5S/c1-19(14-10-6-11(20)17-13(10)15-7-16-14)9-4-8(5-9)18-25(23,24)3-2-12(21)22/h7-9,18H,2-6H2,1H3,(H,21,22)(H,15,16,17,20)/t8-,9+

HIDE SMILES / InChI

Molecular Formula C14H19N5O5S
Molecular Weight 369.396
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:16:16 GMT 2023
Edited
by admin
on Sat Dec 16 19:16:16 GMT 2023
Record UNII
525QBJ4XJG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PF-07095462
Code English
3-(N-((1s,3s)-3-(methyl(6-oxo-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutyl)sulfamoyl)propanoic acid
Systematic Name English
ABROCITINIB METABOLITE M6
Common Name English
Code System Code Type Description
FDA UNII
525QBJ4XJG
Created by admin on Sat Dec 16 19:16:16 GMT 2023 , Edited by admin on Sat Dec 16 19:16:16 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE