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Details

Stereochemistry ACHIRAL
Molecular Formula C24H26N6O2
Molecular Weight 430.5022
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0
Stereo Comments Meso

SHOW SMILES / InChI
Structure of EPITINIB

SMILES

CCN1CCN(CC1)C(=O)NC2=C(OC)C=C3N=CN=C(NC4=CC(=CC=C4)C#C)C3=C2

InChI

InChIKey=DQAZPZIYEOGZAF-UHFFFAOYSA-N
InChI=1S/C24H26N6O2/c1-4-17-7-6-8-18(13-17)27-23-19-14-21(22(32-3)15-20(19)25-16-26-23)28-24(31)30-11-9-29(5-2)10-12-30/h1,6-8,13-16H,5,9-12H2,2-3H3,(H,28,31)(H,25,26,27)

HIDE SMILES / InChI

Molecular Formula C24H26N6O2
Molecular Weight 430.5022
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 14:00:02 UTC 2023
Edited
by admin
on Sat Dec 16 14:00:02 UTC 2023
Record UNII
WZ97ZE4UUG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
EPITINIB
Common Name English
HMPL-813
Code English
Epitinib [WHO-DD]
Common Name English
4-ETHYL-N-(4-((3-ETHYNYLPHENYL)AMINO)-7-METHOXY-6-QUINAZOLINYL)-1-PIPERAZINECARBOXAMIDE
Common Name English
Code System Code Type Description
CAS
1799706-84-5
Created by admin on Sat Dec 16 14:00:02 UTC 2023 , Edited by admin on Sat Dec 16 14:00:02 UTC 2023
NO STRUCTURE GIVEN
CAS
1203902-67-3
Created by admin on Sat Dec 16 14:00:02 UTC 2023 , Edited by admin on Sat Dec 16 14:00:02 UTC 2023
PRIMARY
PUBCHEM
59142777
Created by admin on Sat Dec 16 14:00:02 UTC 2023 , Edited by admin on Sat Dec 16 14:00:02 UTC 2023
PRIMARY
FDA UNII
WZ97ZE4UUG
Created by admin on Sat Dec 16 14:00:02 UTC 2023 , Edited by admin on Sat Dec 16 14:00:02 UTC 2023
PRIMARY
SMS_ID
300000046567
Created by admin on Sat Dec 16 14:00:02 UTC 2023 , Edited by admin on Sat Dec 16 14:00:02 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY
Name Property Type Amount Referenced Substance Defining Parameters References
Biological Half-life PHARMACOKINETIC