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Details

Stereochemistry ACHIRAL
Molecular Formula C23H27N3O3S
Molecular Weight 425.544
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of QUETIAPINE ACETATE

SMILES

CC(=O)OCCOCCN1CCN(CC1)C2=NC3=C(SC4=CC=CC=C24)C=CC=C3

InChI

InChIKey=PBAGNAROQHNFON-UHFFFAOYSA-N
InChI=1S/C23H27N3O3S/c1-18(27)29-17-16-28-15-14-25-10-12-26(13-11-25)23-19-6-2-4-8-21(19)30-22-9-5-3-7-20(22)24-23/h2-9H,10-17H2,1H3

HIDE SMILES / InChI

Molecular Formula C23H27N3O3S
Molecular Weight 425.544
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 Sat Dec 16 10:32:39 UTC 2023
Edited
by admin
on Sat Dec 16 10:32:39 UTC 2023
Record UNII
KG5376GG5M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
QUETIAPINE ACETATE
Common Name English
2-(2-(4-(DIBENZO(B,F)(1,4)THIAZEPIN-11-YL)PIPERAZIN-1-YL)ETHOXY)ETHYL ACETATE [EP IMPURITY]
Common Name English
2-(2-(4-(DIBENZO(B,F)(1,4)THIAZEPIN-11-YL)PIPERAZIN-1-YL)ETHOXY)ETHYL ACETATE
Systematic Name English
11-(4-(2-(2-ACETOXYETHOXY)ETHYL)PIPERAZIN-1-YL)DIBENZO(B,F)(A,4)THIAZEPINE
Systematic Name English
QUETIAPINE FUMARATE IMPURITY A [EP IMPURITY]
Common Name English
ETHANOL, 2-(2-(4-DIBENZO(B,F)(1,4)THIAZEPIN-11-YL-1-PIPERAZINYL)ETHOXY)-, 1-ACETATE
Systematic Name English
Code System Code Type Description
FDA UNII
KG5376GG5M
Created by admin on Sat Dec 16 10:32:39 UTC 2023 , Edited by admin on Sat Dec 16 10:32:39 UTC 2023
PRIMARY
CAS
844639-07-2
Created by admin on Sat Dec 16 10:32:39 UTC 2023 , Edited by admin on Sat Dec 16 10:32:39 UTC 2023
PRIMARY
PUBCHEM
11487114
Created by admin on Sat Dec 16 10:32:39 UTC 2023 , Edited by admin on Sat Dec 16 10:32:39 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP