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Details

Stereochemistry ACHIRAL
Molecular Formula C17H15BrClFN4O3.H2O4S
Molecular Weight 555.76
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SELUMETINIB SULFATE

SMILES

OS(O)(=O)=O.CN1C=NC2=C(F)C(NC3=CC=C(Br)C=C3Cl)=C(C=C12)C(=O)NOCCO

InChI

InChIKey=GRKFGZYYYYISDX-UHFFFAOYSA-N
InChI=1S/C17H15BrClFN4O3.H2O4S/c1-24-8-21-16-13(24)7-10(17(26)23-27-5-4-25)15(14(16)20)22-12-3-2-9(18)6-11(12)19;1-5(2,3)4/h2-3,6-8,22,25H,4-5H2,1H3,(H,23,26);(H2,1,2,3,4)

HIDE SMILES / InChI

Molecular Formula C17H15BrClFN4O3
Molecular Weight 457.681
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula H2O4S
Molecular Weight 98.078
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 16:53:24 UTC 2023
Edited
by admin
on Fri Dec 15 16:53:24 UTC 2023
Record UNII
807ME4B7IJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SELUMETINIB SULFATE
USAN   WHO-DD  
USAN  
Official Name English
1H-BENZIMIDAZOLE-6-CARBOXAMIDE, 5-((4-BROMO-2-CHLOROPHENYL)AMINO)-4-FLUORO-N-(2- HYDROXYETHOXY)-1-METHYL-, SULFATE (1:1)
Systematic Name English
KOSELUGO
Brand Name English
AZD6244 HYDROGEN SULPHATE
Common Name English
5-((4-BROMO-2-CHLOROPHENYL)AMINO)-4-FLUORO-N-(2-HYDROXYETHOXY)-1-METHYL-1H- BENZIMIDAZOLE-6-CARBOXAMIDE SULFATE
Systematic Name English
SELUMETINIB SULFATE [ORANGE BOOK]
Common Name English
SELUMETINIB SULFATE [JAN]
Common Name English
1H-BENZIMIDAZOLE-6-CARBOXAMIDE, 5-((4-BROMO-2-CHLOROPHENYL)AMINO)-4-FLUORO-N-(2- HYDROXYETHOXY)-1-METHYL-, SULPHATE (1:1)
Systematic Name English
SELUMETINIB SULPHATE
Common Name English
AZD6244 HYDROGEN SULFATE
Code English
AZD-6244 HYDROGEN SULPHATE
Common Name English
AZD-6244 HYDROGEN SULFATE
Code English
Selumetinib sulfate [WHO-DD]
Common Name English
SELUMETINIB SULFATE [USAN]
Common Name English
AZD-6244 HYD-SULFATE
Code English
5-((4-BROMO-2-CHLOROPHENYL)AMINO)-4-FLUORO-N-(2-HYDROXYETHOXY)-1-METHYL-1H- BENZIMIDAZOLE-6-CARBOXAMIDE SULPHATE
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C69145
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
NCI_THESAURUS C129825
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
Code System Code Type Description
USAN
XX-37
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
PRIMARY
ChEMBL
CHEMBL1614701
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
PRIMARY
EVMPD
SUB36237
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
PRIMARY
EPA CompTox
DTXSID40241430
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
PRIMARY
CAS
943332-08-9
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
PRIMARY
RXCUI
2361596
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
PRIMARY
FDA UNII
807ME4B7IJ
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
PRIMARY
SMS_ID
100000128757
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
PRIMARY
NCI_THESAURUS
C95225
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
PRIMARY
PUBCHEM
16214875
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
PRIMARY
DRUG BANK
DBSALT002048
Created by admin on Fri Dec 15 16:53:24 UTC 2023 , Edited by admin on Fri Dec 15 16:53:24 UTC 2023
PRIMARY
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PARENT -> SALT/SOLVATE
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ACTIVE MOIETY