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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H22F3N5O3S
Molecular Weight 505.513
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[(3S,4R)-3-Ethyl-4-[3-[(4-methylphenyl)sulfonyl]-3H-imidazo[1,2-a]pyrrolo[2,3-e]pyrazin-8-yl]-1-pyrrolidinyl]-2,2,2-trifluoroethanone

SMILES

CC[C@@H]1CN(C[C@@H]1C2=CN=C3C=NC4=C(C=CN4S(=O)(=O)C5=CC=C(C)C=C5)N23)C(=O)C(F)(F)F

InChI

InChIKey=LNUKYJWZESHVHA-WBVHZDCISA-N
InChI=1S/C23H22F3N5O3S/c1-3-15-12-29(22(32)23(24,25)26)13-17(15)19-10-27-20-11-28-21-18(31(19)20)8-9-30(21)35(33,34)16-6-4-14(2)5-7-16/h4-11,15,17H,3,12-13H2,1-2H3/t15-,17+/m1/s1

HIDE SMILES / InChI

Molecular Formula C23H22F3N5O3S
Molecular Weight 505.513
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 Wed Apr 02 19:35:31 GMT 2025
Edited
by admin
on Wed Apr 02 19:35:31 GMT 2025
Record UNII
CJ3B675L5H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ethanone, 1-[(3S,4R)-3-ethyl-4-[3-[(4-methylphenyl)sulfonyl]-3H-imidazo[1,2-a]pyrrolo[2,3-e]pyrazin-8-yl]-1-pyrrolidinyl]-2,2,2-trifluoro-
Preferred Name English
1-[(3S,4R)-3-Ethyl-4-[3-[(4-methylphenyl)sulfonyl]-3H-imidazo[1,2-a]pyrrolo[2,3-e]pyrazin-8-yl]-1-pyrrolidinyl]-2,2,2-trifluoroethanone
Systematic Name English
Code System Code Type Description
FDA UNII
CJ3B675L5H
Created by admin on Wed Apr 02 19:35:31 GMT 2025 , Edited by admin on Wed Apr 02 19:35:31 GMT 2025
PRIMARY
CAS
2768445-19-6
Created by admin on Wed Apr 02 19:35:31 GMT 2025 , Edited by admin on Wed Apr 02 19:35:31 GMT 2025
PRIMARY
PUBCHEM
171390174
Created by admin on Wed Apr 02 19:35:31 GMT 2025 , Edited by admin on Wed Apr 02 19:35:31 GMT 2025
PRIMARY