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Details

Stereochemistry ACHIRAL
Molecular Formula C31H42N6O4
Molecular Weight 562.703
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TANDUTINIB

SMILES

COC1=CC2=C(N=CN=C2C=C1OCCCN3CCCCC3)N4CCN(CC4)C(=O)NC5=CC=C(OC(C)C)C=C5

InChI

InChIKey=UXXQOJXBIDBUAC-UHFFFAOYSA-N
InChI=1S/C31H42N6O4/c1-23(2)41-25-10-8-24(9-11-25)34-31(38)37-17-15-36(16-18-37)30-26-20-28(39-3)29(21-27(26)32-22-33-30)40-19-7-14-35-12-5-4-6-13-35/h8-11,20-23H,4-7,12-19H2,1-3H3,(H,34,38)

HIDE SMILES / InChI

Molecular Formula C31H42N6O4
Molecular Weight 562.703
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 Fri Dec 15 16:00:53 UTC 2023
Edited
by admin
on Fri Dec 15 16:00:53 UTC 2023
Record UNII
E1IO3ICJ9A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TANDUTINIB
INN   USAN   WHO-DD  
USAN   INN  
Official Name English
4-[6-Methoxy-7-[3-(piperidin-1-yl)propoxy]quinazolin-4-yl]-N-[4-(1-methylethoxy)phenyl]piperazine-1-carboxamide
Systematic Name English
Tandutinib [WHO-DD]
Common Name English
CT-53518
Code English
NSC-759851
Code English
MLN-518
Code English
CT53518
Code English
tandutinib [INN]
Common Name English
TANDUTINIB [USAN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C129825
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
NCI_THESAURUS C1967
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
Code System Code Type Description
CHEBI
90237
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
SMS_ID
100000143101
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
MESH
C464670
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
EPA CompTox
DTXSID8048947
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
EVMPD
SUB118670
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
DRUG BANK
DB05465
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
PUBCHEM
3038522
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
USAN
OO-66
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
NCI_THESAURUS
C48404
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
FDA UNII
E1IO3ICJ9A
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
NSC
759851
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
INN
8501
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
CAS
387867-13-2
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
ChEMBL
CHEMBL124660
Created by admin on Fri Dec 15 16:00:53 UTC 2023 , Edited by admin on Fri Dec 15 16:00:53 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
TARGET -> INHIBITOR
TARGET -> INHIBITOR
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY