2-(((2S)-1-(5-(4-FLUOROPHENYL)-2-METHYL-THIAZOLE-4-CARBONYL)-2-PIPERIDYL)METHYL)-3,5-DIHYDROXY-3,4-DIHYDROISOQUINOLIN-1-ONE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C26H26FN3O4S
Molecular Weight	495.566
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(((2S)-1-(5-(4-FLUOROPHENYL)-2-METHYL-THIAZOLE-4-CARBONYL)-2-PIPERIDYL)METHYL)-3,5-DIHYDROXY-3,4-DIHYDROISOQUINOLIN-1-ONE

Structure Search

SMILES

CC1=NC(C(=O)N2CCCC[C@H]2CN3C(O)CC4=C(O)C=CC=C4C3=O)=C(S1)C5=CC=C(F)C=C5

InChI

InChIKey=IPGNSJNVSLZJCQ-HXBUSHRASA-N

InChI=1S/C26H26FN3O4S/c1-15-28-23(24(35-15)16-8-10-17(27)11-9-16)26(34)29-12-3-2-5-18(29)14-30-22(32)13-20-19(25(30)33)6-4-7-21(20)31/h4,6-11,18,22,31-32H,2-3,5,12-14H2,1H3/t18-,22?/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

2-(((2S)-1-(5-(4-FLUOROPHENYL)-2-METHYL-THIAZOLE-4-CARBONYL)-2-PIPERIDYL)METHYL)-3,5-DIHYDROXY-3,4-DIHYDROISOQUINOLIN-1-ONE

Systematic Name

English

SB-649868 METABOLITE M98

Common Name

English

GSK2329163

Common Name

English

Code System Code Type Description

FDA UNII

Y5WE8M2JH9

Created by admin on Sat Dec 16 16:10:42 GMT 2023 , Edited by admin on Sat Dec 16 16:10:42 GMT 2023

PRIMARY

PUBCHEM

118753319

Created by admin on Sat Dec 16 16:10:42 GMT 2023 , Edited by admin on Sat Dec 16 16:10:42 GMT 2023

PRIMARY

PARENT (METABOLITE)


					1L1V1K2M4V

SB-649868

SUBSTANCE RECORD


					Y5WE8M2JH9

2-(((2S)-1-(5-(4-FLUOROPHENYL)-2-METHYL-THIAZOLE-4-CARBONYL)-2-PIPERIDYL)METHYL)-3,5-DIHYDROXY-3,4-DIHYDROISOQUINOLIN-1-ONE