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Details

Stereochemistry ACHIRAL
Molecular Formula C22H22F3N3O3
Molecular Weight 433.4236
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GSK-2636771

SMILES

CC1=NC2=C(C=C(C=C2C(O)=O)N3CCOCC3)N1CC4=CC=CC(=C4C)C(F)(F)F

InChI

InChIKey=XTKLTGBKIDQGQL-UHFFFAOYSA-N
InChI=1S/C22H22F3N3O3/c1-13-15(4-3-5-18(13)22(23,24)25)12-28-14(2)26-20-17(21(29)30)10-16(11-19(20)28)27-6-8-31-9-7-27/h3-5,10-11H,6-9,12H2,1-2H3,(H,29,30)

HIDE SMILES / InChI

Molecular Formula C22H22F3N3O3
Molecular Weight 433.4236
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:15:38 UTC 2023
Edited
by admin
on Fri Dec 15 15:15:38 UTC 2023
Record UNII
DW94IAT0LS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
GSK-2636771
Common Name English
GSK2636771
Code English
GSK 2636771 [WHO-DD]
Common Name English
2-METHYL-1-((2-METHYL-3-(TRIFLUOROMETHYL)PHENYL)METHYL)-6-(4-MORPHOLINYL)-1H-BENZIMIDAZOLE-4-CARBOXYLIC ACID
Systematic Name English
2-METHYL-1-((2-METHYL-3-(TRIFLUOROMETHYL)PHENYL)METHYL)-6-MORPHOLINO-BENZIMIDAZOLE-4-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
DRUG BANK
DB11795
Created by admin on Fri Dec 15 15:15:38 UTC 2023 , Edited by admin on Fri Dec 15 15:15:38 UTC 2023
PRIMARY
ChEMBL
CHEMBL3188551
Created by admin on Fri Dec 15 15:15:38 UTC 2023 , Edited by admin on Fri Dec 15 15:15:38 UTC 2023
PRIMARY
NCI_THESAURUS
C106261
Created by admin on Fri Dec 15 15:15:38 UTC 2023 , Edited by admin on Fri Dec 15 15:15:38 UTC 2023
PRIMARY
SMS_ID
300000034864
Created by admin on Fri Dec 15 15:15:38 UTC 2023 , Edited by admin on Fri Dec 15 15:15:38 UTC 2023
PRIMARY
PUBCHEM
56949517
Created by admin on Fri Dec 15 15:15:38 UTC 2023 , Edited by admin on Fri Dec 15 15:15:38 UTC 2023
PRIMARY
FDA UNII
DW94IAT0LS
Created by admin on Fri Dec 15 15:15:38 UTC 2023 , Edited by admin on Fri Dec 15 15:15:38 UTC 2023
PRIMARY
EPA CompTox
DTXSID10160124
Created by admin on Fri Dec 15 15:15:38 UTC 2023 , Edited by admin on Fri Dec 15 15:15:38 UTC 2023
PRIMARY
CAS
1372540-25-4
Created by admin on Fri Dec 15 15:15:38 UTC 2023 , Edited by admin on Fri Dec 15 15:15:38 UTC 2023
PRIMARY
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