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Details

Stereochemistry ACHIRAL
Molecular Formula C28H25ClN6O3
Molecular Weight 528.989
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of (E)-N-(4-((3-chloro-4-(pyridin-2-ylmethoxy)phenyl)amino)-3-cyano-7-hydroxyquinolin-6-yl)-4-(dimethylamino)but-2-enamide

SMILES

CN(C)C\C=C\C(=O)NC1=CC2=C(NC3=CC=C(OCC4=NC=CC=C4)C(Cl)=C3)C(=CN=C2C=C1O)C#N

InChI

InChIKey=IYVCEZRPGPNTJM-FNORWQNLSA-N
InChI=1S/C28H25ClN6O3/c1-35(2)11-5-7-27(37)34-24-13-21-23(14-25(24)36)32-16-18(15-30)28(21)33-19-8-9-26(22(29)12-19)38-17-20-6-3-4-10-31-20/h3-10,12-14,16,36H,11,17H2,1-2H3,(H,32,33)(H,34,37)/b7-5+

HIDE SMILES / InChI

Molecular Formula C28H25ClN6O3
Molecular Weight 528.989
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 11:59:52 GMT 2025
Edited
by admin
on Wed Apr 02 11:59:52 GMT 2025
Record UNII
STD4YJM34C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(E)-N-(4-((3-chloro-4-(pyridin-2-ylmethoxy)phenyl)amino)-3-cyano-7-hydroxyquinolin-6-yl)-4-(dimethylamino)but-2-enamide
Systematic Name English
2-Butenamide, N-[4-[[3-chloro-4-(2-pyridinylmethoxy)phenyl]amino]-3-cyano-7-hydroxy-6-quinolinyl]-4-(dimethylamino)-
Preferred Name English
Code System Code Type Description
FDA UNII
STD4YJM34C
Created by admin on Wed Apr 02 11:59:53 GMT 2025 , Edited by admin on Wed Apr 02 11:59:53 GMT 2025
PRIMARY
PUBCHEM
137196684
Created by admin on Wed Apr 02 11:59:53 GMT 2025 , Edited by admin on Wed Apr 02 11:59:53 GMT 2025
PRIMARY
CAS
2749974-29-4
Created by admin on Wed Apr 02 11:59:53 GMT 2025 , Edited by admin on Wed Apr 02 11:59:53 GMT 2025
PRIMARY