GSK-598809 L-TARTRATE

Investigational

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H23F4N5OS.C4H6O6
Molecular Weight	631.596
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O[C@H]([C@@H](O)C(O)=O)C(O)=O.CN1C(SCCCN2C[C@@H]3C[C@@]3(C2)C4=C(F)C=C(C=C4)C(F)(F)F)=NN=C1C5=C(C)N=CO5

InChI

InChIKey=OTXHYNSABCZZKN-JCMKDLKJSA-N

InChI=1S/C22H23F4N5OS.C4H6O6/c1-13-18(32-12-27-13)19-28-29-20(30(19)2)33-7-3-6-31-10-15-9-21(15,11-31)16-5-4-14(8-17(16)23)22(24,25)26;5-1(3(7)8)2(6)4(9)10/h4-5,8,12,15H,3,6-7,9-11H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10)/t15-,21-;1-,2-/m01/s1

HIDE SMILES / InChI

Molecular Formula	C22H23F4N5OS
Molecular Weight	481.51
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Molecular Formula	C4H6O6
Molecular Weight	150.0868
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 `Fri Dec 15 16:26:35 GMT 2023` Edited by `admin` on `Fri Dec 15 16:26:35 GMT 2023`
Record UNII	OF90MI59MG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

GSK-598809 L-TARTRATE

Code

English

3-AZABICYCLO(3.1.0)HEXANE, 1-(2-FLUORO-4-(TRIFLUOROMETHYL)PHENYL)-3-(3-((4-METHYL-5-(4-METHYL-5-OXAZOLYL)-4H-1,2,4-TRIAZOL-3-YL)THIO)PROPYL)-, (1S,5R)-, (2R,3R)-2,3-DIHYDROXYBUTANEDIOATE (1:1)

Systematic Name

English

Code System Code Type Description

FDA UNII

OF90MI59MG

Created by admin on Fri Dec 15 16:26:35 GMT 2023 , Edited by admin on Fri Dec 15 16:26:35 GMT 2023

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PUBCHEM

131842268

Created by admin on Fri Dec 15 16:26:35 GMT 2023 , Edited by admin on Fri Dec 15 16:26:35 GMT 2023

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CAS