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

Details

Stereochemistry ACHIRAL
Molecular Formula C24H28FN3O4S
Molecular Weight 473.56
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GSK-894281

SMILES

COC1=CC=C(C=C1NS(=O)(=O)C2=CC=C(C3=CC=C(C)O3)C(F)=C2)N4C[C@H](C)N[C@H](C)C4

InChI

InChIKey=OIWVNMRPHUCLHN-IYBDPMFKSA-N
InChI=1S/C24H28FN3O4S/c1-15-13-28(14-16(2)26-15)18-6-10-24(31-4)22(11-18)27-33(29,30)19-7-8-20(21(25)12-19)23-9-5-17(3)32-23/h5-12,15-16,26-27H,13-14H2,1-4H3/t15-,16+

HIDE SMILES / InChI

Molecular Formula C24H28FN3O4S
Molecular Weight 473.56
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:37:03 UTC 2023
Edited
by admin
on Fri Dec 15 17:37:03 UTC 2023
Record UNII
DHJ6673AS1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GSK-894281
Common Name English
GSK 894281
Code English
GSK894281
Common Name English
BENZENESULFONAMIDE, N-(5-((3R,5S)-3,5-DIMETHYL-1-PIPERAZINYL)-2-METHOXYPHENYL)-3-FLUORO-4-(5-METHYL-2-FURANYL)-, REL-
Common Name English
Code System Code Type Description
CAS
874958-63-1
Created by admin on Fri Dec 15 17:37:03 UTC 2023 , Edited by admin on Fri Dec 15 17:37:03 UTC 2023
PRIMARY
EPA CompTox
DTXSID90236356
Created by admin on Fri Dec 15 17:37:03 UTC 2023 , Edited by admin on Fri Dec 15 17:37:03 UTC 2023
PRIMARY
PUBCHEM
24803511
Created by admin on Fri Dec 15 17:37:03 UTC 2023 , Edited by admin on Fri Dec 15 17:37:03 UTC 2023
PRIMARY
FDA UNII
DHJ6673AS1
Created by admin on Fri Dec 15 17:37:03 UTC 2023 , Edited by admin on Fri Dec 15 17:37:03 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> AGONIST
Related Record Type Details
ACTIVE MOIETY