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Details

Stereochemistry ACHIRAL
Molecular Formula C23H20F3N5O2S2.CH4O3S
Molecular Weight 615.668
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DABRAFENIB MESYLATE

SMILES

CS(O)(=O)=O.CC(C)(C)C1=NC(=C(S1)C2=NC(N)=NC=C2)C3=CC=CC(NS(=O)(=O)C4=C(F)C=CC=C4F)=C3F

InChI

InChIKey=YKGMKSIHIVVYKY-UHFFFAOYSA-N
InChI=1S/C23H20F3N5O2S2.CH4O3S/c1-23(2,3)21-30-18(19(34-21)16-10-11-28-22(27)29-16)12-6-4-9-15(17(12)26)31-35(32,33)20-13(24)7-5-8-14(20)25;1-5(2,3)4/h4-11,31H,1-3H3,(H2,27,28,29);1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula CH4O3S
Molecular Weight 96.106
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C23H20F3N5O2S2
Molecular Weight 519.562
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 Sat Dec 16 01:37:18 UTC 2023
Edited
by admin
on Sat Dec 16 01:37:18 UTC 2023
Record UNII
B6DC89I63E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DABRAFENIB MESYLATE
ORANGE BOOK   USAN  
USAN  
Official Name English
GSK-2118436B
Code English
DABRAFENIB MESYLATE [USAN]
Common Name English
DABRAFENIB MESYLATE [MI]
Common Name English
DABRAFENIB MESYLATE [ORANGE BOOK]
Common Name English
GSK-2118436B METHANESULFONATE SALT
Code English
GSK-2118436B MESYLATE
Code English
DABRAFENIB MESILATE
WHO-DD  
Common Name English
GSK2118436B, METHANE SULFONATE SALT
Code English
GSK2118436B
Code English
TAFINLAR
Brand Name English
BENZENESULFONAMIDE, N-(3-(5-(2-AMINO-4-PYRIMIDINYL)-2-(1,1-DIMETHYLETHYL)-4-THIAZOLYL)- 2-FLUOROPHENYL)-2,6-DIFLUORO-, METHANESULFONATE (1:1)
Systematic Name English
Dabrafenib mesilate [WHO-DD]
Common Name English
DABRAFENIB MESILATE [JAN]
Common Name English
N-(3-(5-(2-AMINOPYRIMIDIN-4-YL)-2-(1,1-DIMETHYLETHYL)THIAZOL-4-YL)-2-FLUOROPHENYL)-2,6- DIFLUOROBENZENESULFONAMIDE MONOMETHANESULFONATE
Systematic Name English
GSK-2118436 METHANESULFONATE SALT
Code English
Classification Tree Code System Code
NCI_THESAURUS C129825
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
NCI_THESAURUS C155322
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
Code System Code Type Description
EVMPD
SUB128623
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
DRUG BANK
DBSALT000036
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
NCI_THESAURUS
C128059
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
EPA CompTox
DTXSID70152500
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
DAILYMED
B6DC89I63E
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
RXCUI
1425222
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY RxNorm
CAS
1195768-06-9
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
CHEBI
75048
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
ChEMBL
CHEMBL2028663
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
MERCK INDEX
m11719
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
USAN
XX-157
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
PUBCHEM
44516822
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
SMS_ID
100000154410
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
FDA UNII
B6DC89I63E
Created by admin on Sat Dec 16 01:37:18 UTC 2023 , Edited by admin on Sat Dec 16 01:37:18 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY