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Details

Stereochemistry ACHIRAL
Molecular Formula C20H17Cl2N3O2
Molecular Weight 402.274
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6,7-Bis(2-chloroethoxy)-N-(3-ethynylphenyl)-4-quinazolinamine

SMILES

ClCCOC1=CC2=NC=NC(NC3=CC=CC(=C3)C#C)=C2C=C1OCCCl

InChI

InChIKey=OPZQXOBOVGSGMM-UHFFFAOYSA-N
InChI=1S/C20H17Cl2N3O2/c1-2-14-4-3-5-15(10-14)25-20-16-11-18(26-8-6-21)19(27-9-7-22)12-17(16)23-13-24-20/h1,3-5,10-13H,6-9H2,(H,23,24,25)

HIDE SMILES / InChI

Molecular Formula C20H17Cl2N3O2
Molecular Weight 402.274
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 Wed Apr 02 17:45:52 GMT 2025
Edited
by admin
on Wed Apr 02 17:45:52 GMT 2025
Record UNII
EVS3LP8NDM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6,7-Bis(2-chloroethoxy)-N-(3-ethynylphenyl)-4-quinazolinamine
Systematic Name English
Erlotinib impurity
Preferred Name English
Erlotinib impurity, 6,7-bis(2-chloroethoxy)
Common Name English
6,7-Bis(2-chloroethoxy)-N-(3-ethynylphenyl)quinazolin-4-amine
Systematic Name English
4-Quinazolinamine, 6,7-bis(2-chloroethoxy)-N-(3-ethynylphenyl)-
Systematic Name English
Code System Code Type Description
PUBCHEM
16045653
Created by admin on Wed Apr 02 17:45:52 GMT 2025 , Edited by admin on Wed Apr 02 17:45:52 GMT 2025
PRIMARY
CAS
183321-82-6
Created by admin on Wed Apr 02 17:45:52 GMT 2025 , Edited by admin on Wed Apr 02 17:45:52 GMT 2025
PRIMARY
FDA UNII
EVS3LP8NDM
Created by admin on Wed Apr 02 17:45:52 GMT 2025 , Edited by admin on Wed Apr 02 17:45:52 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT