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Details

Stereochemistry ACHIRAL
Molecular Formula C33H31F2N3O7
Molecular Weight 619.6119
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Canlitinib

SMILES

COC1=CC2=C(C=C1OCCCCCC(O)=O)N=CC=C2OC3=C(F)C=C(NC(=O)C4(CC4)C(=O)NC5=CC=C(F)C=C5)C=C3

InChI

InChIKey=PCKYITPVOLEZKL-UHFFFAOYSA-N
InChI=1S/C33H31F2N3O7/c1-43-28-18-23-25(19-29(28)44-16-4-2-3-5-30(39)40)36-15-12-26(23)45-27-11-10-22(17-24(27)35)38-32(42)33(13-14-33)31(41)37-21-8-6-20(34)7-9-21/h6-12,15,17-19H,2-5,13-14,16H2,1H3,(H,37,41)(H,38,42)(H,39,40)

HIDE SMILES / InChI

Molecular Formula C33H31F2N3O7
Molecular Weight 619.6119
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 20:10:20 UTC 2023
Edited
by admin
on Sat Dec 16 20:10:20 UTC 2023
Record UNII
PFR26A3AWM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Canlitinib
INN  
Official Name English
6-[[4-[2-Fluoro-4-[[[1-[[(4-fluorophenyl)amino]carbonyl]cyclopropyl]carbonyl]amino]phenoxy]-6-methoxy-7-quinolinyl]oxy]hexanoic acid
Systematic Name English
canlitinib [INN]
Common Name English
Hexanoic acid, 6-[[4-[2-fluoro-4-[[[1-[[(4-fluorophenyl)amino]carbonyl]cyclopropyl]carbonyl]amino]phenoxy]-6-methoxy-7-quinolinyl]oxy]-
Systematic Name English
Code System Code Type Description
PUBCHEM
139415233
Created by admin on Sat Dec 16 20:10:20 UTC 2023 , Edited by admin on Sat Dec 16 20:10:20 UTC 2023
PRIMARY
CAS
2222730-78-9
Created by admin on Sat Dec 16 20:10:20 UTC 2023 , Edited by admin on Sat Dec 16 20:10:20 UTC 2023
PRIMARY
INN
12642
Created by admin on Sat Dec 16 20:10:20 UTC 2023 , Edited by admin on Sat Dec 16 20:10:20 UTC 2023
PRIMARY
FDA UNII
PFR26A3AWM
Created by admin on Sat Dec 16 20:10:20 UTC 2023 , Edited by admin on Sat Dec 16 20:10:20 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY