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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H25F4N3O4S
Molecular Weight 515.521
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BI-653048 FREE BASE

SMILES

CCS(=O)(=O)C1=CC2=C(NC(C[C@](O)(CC(C)(C)C3=CC=C(F)C=C3C(N)=O)C(F)(F)F)=C2)C=N1

InChI

InChIKey=AUIFRJWXYUNPPV-QFIPXVFZSA-N
InChI=1S/C23H25F4N3O4S/c1-4-35(33,34)19-8-13-7-15(30-18(13)11-29-19)10-22(32,23(25,26)27)12-21(2,3)17-6-5-14(24)9-16(17)20(28)31/h5-9,11,30,32H,4,10,12H2,1-3H3,(H2,28,31)/t22-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
BI-653048 FREE BASE
Common Name English
2-((3R)-3-((5-(ETHYLSULFONYL)-1H-PYRROLO(2,3-C)PYRIDIN-2-YL)METHYL)-4,4,4-TRIFLUORO-3-HYDROXY-1,1-DIMETHYLBUTYL)-5-FLUOROBENZAMIDE
Preferred Name English
2-((4R)-4-((5-ETHYLSULFONYL-1H-PYRROLO(2,3-C)PYRIDIN-2-YL)METHYL)-5,5,5-TRIFLUORO-4-HYDROXY-2-METHYLPENTAN-2-YL)-5-FLUOROBENZAMIDE
Systematic Name English
BENZAMIDE, 2-((3R)-3-((5-(ETHYLSULFONYL)-1H-PYRROLO(2,3-C)PYRIDIN-2-YL)METHYL)-4,4,4-TRIFLUORO-3-HYDROXY-1,1-DIMETHYLBUTYL)-5-FLUORO-
Systematic Name English
Code System Code Type Description
CAS
1198784-72-3
Created by admin on Wed Apr 02 13:03:28 GMT 2025 , Edited by admin on Wed Apr 02 13:03:28 GMT 2025
PRIMARY
PUBCHEM
44543970
Created by admin on Wed Apr 02 13:03:28 GMT 2025 , Edited by admin on Wed Apr 02 13:03:28 GMT 2025
PRIMARY
FDA UNII
KQ33EVH4KU
Created by admin on Wed Apr 02 13:03:28 GMT 2025 , Edited by admin on Wed Apr 02 13:03:28 GMT 2025
PRIMARY