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Details

Stereochemistry ACHIRAL
Molecular Formula C19H21N3S
Molecular Weight 323.455
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Des(2-hydroxyethoxy)quetiapine

SMILES

CCN1CCN(CC1)C2=NC3=C(SC4=C2C=CC=C4)C=CC=C3

InChI

InChIKey=KUKQJNQKJWEVCE-UHFFFAOYSA-N
InChI=1S/C19H21N3S/c1-2-21-11-13-22(14-12-21)19-15-7-3-5-9-17(15)23-18-10-6-4-8-16(18)20-19/h3-10H,2,11-14H2,1H3

HIDE SMILES / InChI

Molecular Formula C19H21N3S
Molecular Weight 323.455
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 Mon Mar 31 23:21:48 GMT 2025
Edited
by admin
on Mon Mar 31 23:21:48 GMT 2025
Record UNII
RWH9KS2BXZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
11-(4-ETHYLPIPERAZIN-1-YL)DIBENZO(B,F)(1,4)THIAZEPINE
Preferred Name English
Des(2-hydroxyethoxy)quetiapine
Common Name English
N-ETHYL QUETIAPINE [USP IMPURITY]
Common Name English
11-(4-Ethyl-1-piperazinyl)dibenzo(b,f)(1,4)thiazepine
Systematic Name English
DIBENZO(B,F)(1,4)THIAZEPINE, 11-(4-ETHYL-1-PIPERAZINYL)-
Systematic Name English
N-ETHYL QUETIAPINE
Common Name English
QUETIAPINE FUMARATE IMPURITY P [EP IMPURITY]
Common Name English
Code System Code Type Description
FDA UNII
RWH9KS2BXZ
Created by admin on Mon Mar 31 23:21:48 GMT 2025 , Edited by admin on Mon Mar 31 23:21:48 GMT 2025
PRIMARY
CAS
1011758-03-4
Created by admin on Mon Mar 31 23:21:48 GMT 2025 , Edited by admin on Mon Mar 31 23:21:48 GMT 2025
PRIMARY
EPA CompTox
DTXSID101212479
Created by admin on Mon Mar 31 23:21:48 GMT 2025 , Edited by admin on Mon Mar 31 23:21:48 GMT 2025
PRIMARY
PUBCHEM
24740450
Created by admin on Mon Mar 31 23:21:48 GMT 2025 , Edited by admin on Mon Mar 31 23:21:48 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP