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Details

Stereochemistry ABSOLUTE
Molecular Formula C31H36F4N4O4S
Molecular Weight 636.701
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GSK-188909

SMILES

CCNC1=CC(N2CCCCS2(=O)=O)=C(F)C(=C1)C(=O)N[C@@H](CC3=CC=CC=C3)[C@H](O)CNCC4=CC=CC(=C4)C(F)(F)F

InChI

InChIKey=DGEILIRHSDUTDK-XTEPFMGCSA-N
InChI=1S/C31H36F4N4O4S/c1-2-37-24-17-25(29(32)27(18-24)39-13-6-7-14-44(39,42)43)30(41)38-26(16-21-9-4-3-5-10-21)28(40)20-36-19-22-11-8-12-23(15-22)31(33,34)35/h3-5,8-12,15,17-18,26,28,36-37,40H,2,6-7,13-14,16,19-20H2,1H3,(H,38,41)/t26-,28+/m0/s1

HIDE SMILES / InChI

Molecular Formula C31H36F4N4O4S
Molecular Weight 636.701
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 10:08:10 GMT 2023
Edited
by admin
on Sat Dec 16 10:08:10 GMT 2023
Record UNII
FC2VW8EJD2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GSK-188909
Common Name English
3-(1,1-DIOXOTETRAHYDRO-2H-1,2-THIAZIN-2-YL)-5-(ETHYLAMINO)-2-FLUORO-N-((1S,2R)-2-HYDROXY-1-(PHENYLMETHYL)-3-(((3-(TRIFLUOROMETHYL)PHENYL)METHYL)AMINO)PROPYL)BENZAMIDE
Systematic Name English
N-((2-(4-(2-ETHYL-4,6-DIMETHYL-1H-IMIDAZO(4,5-C)PYRIDIN-1-YL)PHENYL)ETHYL)CARBAMOYL)-4-METHYLBENZENESULFONAMIDE
Systematic Name English
BENZAMIDE, 5-(ETHYLAMINO)-2-FLUORO-N-((1S,2R)-2-HYDROXY-1-(PHENYLMETHYL)-3-(((3-(TRIFLUOROMETHYL)PHENYL)METHYL)AMINO)PROPYL)-3-(TETRAHYDRO-1,1-DIOXIDO-2H-1,2-THIAZIN-2-YL)-
Systematic Name English
5-(ETHYLAMINO)-2-FLUORO-N-((1S,2R)-2-HYDROXY-1-(PHENYLMETHYL)-3-(((3-(TRIFLUOROMETHYL)PHENYL)METHYL)AMINO)PROPYL)-3-(TETRAHYDRO-1,1-DIOXIDO-2H-1,2-THIAZIN-2-YL)BENZAMIDE
Systematic Name English
Code System Code Type Description
PUBCHEM
15981486
Created by admin on Sat Dec 16 10:08:11 GMT 2023 , Edited by admin on Sat Dec 16 10:08:11 GMT 2023
PRIMARY
CAS
706802-34-8
Created by admin on Sat Dec 16 10:08:11 GMT 2023 , Edited by admin on Sat Dec 16 10:08:11 GMT 2023
PRIMARY
FDA UNII
FC2VW8EJD2
Created by admin on Sat Dec 16 10:08:11 GMT 2023 , Edited by admin on Sat Dec 16 10:08:11 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY