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Details

Stereochemistry ACHIRAL
Molecular Formula C24H25ClFN5O2
Molecular Weight 469.939
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of DACOMITINIB ANHYDROUS

SMILES

COC1=C(NC(=O)\C=C\CN2CCCCC2)C=C3C(NC4=CC=C(F)C(Cl)=C4)=NC=NC3=C1

InChI

InChIKey=LVXJQMNHJWSHET-AATRIKPKSA-N
InChI=1S/C24H25ClFN5O2/c1-33-22-14-20-17(24(28-15-27-20)29-16-7-8-19(26)18(25)12-16)13-21(22)30-23(32)6-5-11-31-9-3-2-4-10-31/h5-8,12-15H,2-4,9-11H2,1H3,(H,30,32)(H,27,28,29)/b6-5+

HIDE SMILES / InChI

Approval Year

Name Type Language
DACOMITINIB ANHYDROUS
Common Name English
(2E)-N-(4-((3-CHLORO-4-FLUOROPHENYL)AMINO)-7-METHOXYQUINAZOLIN-6-YL)-4-PIPERIDIN-1-YLBUT-2-ENAMIDE
Systematic Name English
PF-00299804
Code English
dacomitinib [INN]
Common Name English
Dacomitinib [WHO-DD]
Common Name English
Code System Code Type Description
INN
9314
Created by admin on Fri Dec 15 16:26:48 UTC 2023 , Edited by admin on Fri Dec 15 16:26:48 UTC 2023
PRIMARY
CAS
1110813-31-4
Created by admin on Fri Dec 15 16:26:48 UTC 2023 , Edited by admin on Fri Dec 15 16:26:48 UTC 2023
PRIMARY
RXCUI
2058848
Created by admin on Fri Dec 15 16:26:48 UTC 2023 , Edited by admin on Fri Dec 15 16:26:48 UTC 2023
PRIMARY
EPA CompTox
DTXSID50149493
Created by admin on Fri Dec 15 16:26:48 UTC 2023 , Edited by admin on Fri Dec 15 16:26:48 UTC 2023
PRIMARY
NCI_THESAURUS
C171723
Created by admin on Fri Dec 15 16:26:48 UTC 2023 , Edited by admin on Fri Dec 15 16:26:48 UTC 2023
PRIMARY
FDA UNII
2XJX250C20
Created by admin on Fri Dec 15 16:26:48 UTC 2023 , Edited by admin on Fri Dec 15 16:26:48 UTC 2023
PRIMARY
PUBCHEM
11511120
Created by admin on Fri Dec 15 16:26:48 UTC 2023 , Edited by admin on Fri Dec 15 16:26:48 UTC 2023
PRIMARY
CHEBI
132268
Created by admin on Fri Dec 15 16:26:48 UTC 2023 , Edited by admin on Fri Dec 15 16:26:48 UTC 2023
PRIMARY
SMS_ID
100000175266
Created by admin on Fri Dec 15 16:26:48 UTC 2023 , Edited by admin on Fri Dec 15 16:26:48 UTC 2023
PRIMARY
DAILYMED
2XJX250C20
Created by admin on Fri Dec 15 16:26:48 UTC 2023 , Edited by admin on Fri Dec 15 16:26:48 UTC 2023
PRIMARY