DIZIPRASIDONE DEGRADANT

Details

Stereochemistry	ACHIRAL
Molecular Formula	C42H38Cl2N8O2S2
Molecular Weight	821.84
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

ClC1=CC2=C(C=C1CCN3CCN(CC3)C4=NSC5=C4C=CC=C5)\C(C(=O)N2)=C6/C(=O)NC7=C6C=C(CCN8CCN(CC8)C9=NSC%10=C9C=CC=C%10)C(Cl)=C7

InChI

InChIKey=CEWVRHPGCDEYCZ-HEFFKOSUSA-N

InChI=1S/C42H38Cl2N8O2S2/c43-31-23-33-29(21-25(31)9-11-49-13-17-51(18-14-49)39-27-5-1-3-7-35(27)55-47-39)37(41(53)45-33)38-30-22-26(32(44)24-34(30)46-42(38)54)10-12-50-15-19-52(20-16-50)40-28-6-2-4-8-36(28)56-48-40/h1-8,21-24H,9-20H2,(H,45,53)(H,46,54)/b38-37+

HIDE SMILES / InChI

Molecular Formula	C42H38Cl2N8O2S2
Molecular Weight	821.84
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 14:11:36 UTC 2023` Edited by `admin` on `Sat Dec 16 14:11:36 UTC 2023`
Record UNII	D9KF7S3KAH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DIZIPRASIDONE DEGRADANT

Common Name

English

5-(2-(4-(1,2-BENZISOTHIAZOL-3-YL)-1-PIPERAZINYL)ETHYL)-3-(5-(2-(4-(1,2-BENZISOTHIAZOL-3-YL)-1-PIPERAZINYL)ETHYL)-6-CHLORO-1,2-DIHYDRO-2-OXO-3H-INDOL-3-YLIDENE)-6-CHLORO-1,3-DIHYDRO-2H-INDOL-2-ONE

Systematic Name

English

2H-INDOL-2-ONE, 5-(2-(4-(1,2-BENZISOTHIAZOL-3-YL)-1-PIPERAZINYL)ETHYL)-3-(5-(2-(4-(1,2-BENZISOTHIAZOL-3-YL)-1-PIPERAZINYL)ETHYL)-6-CHLORO-1,2-DIHYDRO-2-OXO-3H-INDOL-3-YLIDENE)-6-CHLORO-1,3-DIHYDRO-

Systematic Name

English

Code System Code Type Description

CAS

1311090-44-4

Created by admin on Sat Dec 16 14:11:36 UTC 2023 , Edited by admin on Sat Dec 16 14:11:36 UTC 2023

PRIMARY

FDA UNII

D9KF7S3KAH

Created by admin on Sat Dec 16 14:11:36 UTC 2023 , Edited by admin on Sat Dec 16 14:11:36 UTC 2023

PRIMARY

Related Record Type Details


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ZIPRASIDONE

PARENT -> DEGRADENT

Comments:

The final degradant was found to be in the E-configuration.