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Details

Stereochemistry ACHIRAL
Molecular Formula C19H17F6N7O.CH4O3S
Molecular Weight 569.481
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ENASIDENIB MESYLATE

SMILES

CS(O)(=O)=O.CC(C)(O)CNC1=NC(NC2=CC=NC(=C2)C(F)(F)F)=NC(=N1)C3=CC=CC(=N3)C(F)(F)F

InChI

InChIKey=ORZHZQZYWXEDDL-UHFFFAOYSA-N
InChI=1S/C19H17F6N7O.CH4O3S/c1-17(2,33)9-27-15-30-14(11-4-3-5-12(29-11)18(20,21)22)31-16(32-15)28-10-6-7-26-13(8-10)19(23,24)25;1-5(2,3)4/h3-8,33H,9H2,1-2H3,(H2,26,27,28,30,31,32);1H3,(H,2,3,4)

HIDE SMILES / InChI

Molecular Formula C19H17F6N7O
Molecular Weight 473.375
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:07:29 UTC 2023
Edited
by admin
on Sat Dec 16 11:07:29 UTC 2023
Record UNII
UF6PC17XAV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ENASIDENIB MESYLATE
USAN  
USAN  
Official Name English
ENASIDENIB MESYLATE [USAN]
Common Name English
IDHIFA
Brand Name English
2-PROPANOL, 2-METHYL-1-((4-(6-(TRIFLUOROMETHYL)-2-PYRIDINYL)-6-((2-(TRIFLUOROMETHYL)-4-PYRIDINYL)AMINO)-1,3,5-TRIAZIN-2-YL)AMINO)-, METHANESULFONATE (1:1)
Systematic Name English
CC-90007
Code English
Enasidenib mesylate [WHO-DD]
Common Name English
ENASIDENIB METHANESULFONATE
Common Name English
ENASIDENIB MESILATE
Common Name English
ENASIDENIB MESYLATE [MI]
Common Name English
2-Methyl-1-[(4-[6-(trifluoromethyl)pyridin-2-yl]- 6-{[2-(trifluoromethyl)pyridin-4-yl]amino}-1,3,5-triazin- 2-yl)amino]propan-2-ol methanesulfonate
Systematic Name English
AG-221 MESYLATE
Code English
ENASIDENIB MESYLATE [ORANGE BOOK]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C137826
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
EU-Orphan Drug EU/3/16/1640
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
Code System Code Type Description
CAS
1650550-25-6
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
PRIMARY
DRUG BANK
DBSALT002582
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
PRIMARY
DAILYMED
UF6PC17XAV
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
PRIMARY
EPA CompTox
DTXSID501027943
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
PRIMARY
MERCK INDEX
m12047
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
PRIMARY
PUBCHEM
90480031
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
PRIMARY
SMS_ID
100000175240
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
PRIMARY
CHEBI
145374
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
PRIMARY
RXCUI
1940331
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
PRIMARY
FDA UNII
UF6PC17XAV
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
PRIMARY
USAN
DE-122
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
PRIMARY
NCI_THESAURUS
C137825
Created by admin on Sat Dec 16 11:07:29 UTC 2023 , Edited by admin on Sat Dec 16 11:07:29 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
SOLUBILITY CHEMICAL SOLVENT
CHEMICAL
FINAL pH
CHEMICAL
SOLUBILITY CHEMICAL SOLVENT
CHEMICAL
FINAL pH
CHEMICAL