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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H25Cl2N5O3
Molecular Weight 502.393
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-Chloro-Afatinib

SMILES

CN(C)C\C=C\C(=O)NC1=CC2=C(NC3=CC=C(Cl)C(Cl)=C3)N=CN=C2C=C1O[C@H]4CCOC4

InChI

InChIKey=GMLBQFFEIVQHIS-CWDCEQMOSA-N
InChI=1S/C24H25Cl2N5O3/c1-31(2)8-3-4-23(32)30-21-11-17-20(12-22(21)34-16-7-9-33-13-16)27-14-28-24(17)29-15-5-6-18(25)19(26)10-15/h3-6,10-12,14,16H,7-9,13H2,1-2H3,(H,30,32)(H,27,28,29)/b4-3+/t16-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
2-Chloro-Afatinib
Common Name English
(2E)-N-[4-[(3,4-Dichlorophenyl)amino]-7-[[(3S)-tetrahydro-3-furanyl]oxy]-6-quinazolinyl]-4-(dimethylamino)-2-butenamide
Preferred Name English
(S,E)-N-(4-((3,4-Dichlorophenyl)amino)-7-((tetrahydrofuran-3-yl)oxy)quinazolin-6-yl)-4-(dimethylamino)but-2-enamide
Systematic Name English
2-Butenamide, N-[4-[(3,4-dichlorophenyl)amino]-7-[[(3S)-tetrahydro-3-furanyl]oxy]-6-quinazolinyl]-4-(dimethylamino)-, (2E)-
Systematic Name English
Code System Code Type Description
FDA UNII
KQ2BJM2JGT
Created by admin on Wed Apr 02 17:18:58 GMT 2025 , Edited by admin on Wed Apr 02 17:18:58 GMT 2025
PRIMARY
PUBCHEM
154631188
Created by admin on Wed Apr 02 17:18:58 GMT 2025 , Edited by admin on Wed Apr 02 17:18:58 GMT 2025
PRIMARY
CAS
2223677-63-0
Created by admin on Wed Apr 02 17:18:58 GMT 2025 , Edited by admin on Wed Apr 02 17:18:58 GMT 2025
PRIMARY