DES(HYDROXYETHYL) QUETIAPINE DIMER

Details

Stereochemistry	ACHIRAL
Molecular Formula	C40H44N6O2S2
Molecular Weight	704.946
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DES(HYDROXYETHYL) QUETIAPINE DIMER

Structure Search

SMILES

C(COCCN1CCN(CC1)C2=NC3=CC=CC=C3SC4=CC=CC=C24)OCCN5CCN(CC5)C6=NC7=CC=CC=C7SC8=CC=CC=C68

InChI

InChIKey=YBVWRXGWAIZGDD-UHFFFAOYSA-N

InChI=1S/C40H44N6O2S2/c1-5-13-35-31(9-1)39(41-33-11-3-7-15-37(33)49-35)45-21-17-43(18-22-45)25-27-47-29-30-48-28-26-44-19-23-46(24-20-44)40-32-10-2-6-14-36(32)50-38-16-8-4-12-34(38)42-40/h1-16H,17-30H2

HIDE SMILES / InChI

Molecular Formula	C40H44N6O2S2
Molecular Weight	704.946
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 23:19:28 GMT 2025` Edited by `admin` on `Mon Mar 31 23:19:28 GMT 2025`
Record UNII	JOZ426ZS3C
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DES(HYDROXYETHYL) QUETIAPINE DIMER

Common Name

English

QUETIAPINE FUMARATE IMPURITY E [EP IMPURITY]

Preferred Name

English

11,11-(ETHYLENEBIS(OXYETHYLENEPIPERAZINE-4,1-DIYL))BIS(DIBENZO(B,F)(1,4)THIAZEPINE)

Systematic Name

English

1,2-BIS(2-(4-DIBENZO(B,F)(1,4)THIAZEPIN-11-YL-1-PIPERAZINYL)ETHOXY)ETHANE

Systematic Name

English

Code System Code Type Description

PUBCHEM

76764703

Created by admin on Mon Mar 31 23:19:28 GMT 2025 , Edited by admin on Mon Mar 31 23:19:28 GMT 2025

PRIMARY

FDA UNII

JOZ426ZS3C

Created by admin on Mon Mar 31 23:19:28 GMT 2025 , Edited by admin on Mon Mar 31 23:19:28 GMT 2025

PRIMARY

CAS

1371638-05-9

Created by admin on Mon Mar 31 23:19:28 GMT 2025 , Edited by admin on Mon Mar 31 23:19:28 GMT 2025

PRIMARY

Related Record Type Details


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Quetiapine Fumarate

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: