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Details

Stereochemistry ACHIRAL
Molecular Formula C21H16ClF3N4O3.CH4O3S
Molecular Weight 563.949
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DONAFENIB MESYLATE

SMILES

CS(O)(=O)=O.[2H]C([2H])([2H])NC(=O)C1=NC=CC(OC2=CC=C(NC(=O)NC3=CC(=C(Cl)C=C3)C(F)(F)F)C=C2)=C1

InChI

InChIKey=IYEOGVPDPILUDO-NIIDSAIPSA-N
InChI=1S/C21H16ClF3N4O3.CH4O3S/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-13)21(23,24)25;1-5(2,3)4/h2-11H,1H3,(H,26,30)(H2,28,29,31);1H3,(H,2,3,4)/i1D3;

HIDE SMILES / InChI

Molecular Formula C21H16ClF3N4O3
Molecular Weight 467.843
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 15:11:03 UTC 2023
Edited
by admin
on Sat Dec 16 15:11:03 UTC 2023
Record UNII
F3C1QUT2IS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DONAFENIB MESYLATE
Common Name English
CM-4307 MESYLATE
Common Name English
DONAFENIB MESILATE
Common Name English
4-(4-((((4-CHLORO-3-(TRIFLUOROMETHYL)PHENYL)AMINO)CARBONYL)AMINO)PHENOXY)-N-(METHYL-D3)-2-PYRIDINECARBOXAMIDE METHYLSULFONIC ACID SALT
Systematic Name English
Donafenib mesilate [WHO-DD]
Common Name English
Code System Code Type Description
PUBCHEM
145722042
Created by admin on Sat Dec 16 15:11:03 UTC 2023 , Edited by admin on Sat Dec 16 15:11:03 UTC 2023
PRIMARY
FDA UNII
F3C1QUT2IS
Created by admin on Sat Dec 16 15:11:03 UTC 2023 , Edited by admin on Sat Dec 16 15:11:03 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY