1,2-SECO-ZIPRASIDONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H23ClN4O2S
Molecular Weight	430.951
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC1=CC(Cl)=C(CCN2CCN(CC2)C3=NSC4=CC=CC=C34)C=C1CC(O)=O

InChI

InChIKey=VMQKWKNTSXIWGW-UHFFFAOYSA-N

InChI=1S/C21H23ClN4O2S/c22-17-13-18(23)15(12-20(27)28)11-14(17)5-6-25-7-9-26(10-8-25)21-16-3-1-2-4-19(16)29-24-21/h1-4,11,13H,5-10,12,23H2,(H,27,28)

HIDE SMILES / InChI

Molecular Formula	C21H23ClN4O2S
Molecular Weight	430.951
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 10:56:44 UTC 2023` Edited by `admin` on `Sat Dec 16 10:56:44 UTC 2023`
Record UNII	98P5L85D7T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1,2-SECO-ZIPRASIDONE

Common Name

English

2-(2-AMINO-5-(2-(4-(1,2-BENZISOTHIAZOL-3-YL)PIPERAZIN-1-YL)ETHYL)-4-CHLOROPHENYL)ACETIC ACID

Systematic Name

English

ZIPRASIDONE MESILATE TRIHYDRATE IMPURITY C [EP IMPURITY]

Common Name

English

ZIPRASIDONE HYDROCHLORIDE MONOHYDRATE IMPURITY C [EP IMPURITY]

Common Name

English

ZIPRASIDONE HYDROCHLORIDE IMPURITY, ZIPRASIDONE OPEN RING- [USP IMPURITY]

Common Name

English

BENZENEACETIC ACID, 2-AMINO-5-(2-(4-(1,2-BENZISOTHIAZOL-3-YL)-1-PIPERAZINYL)ETHYL)-4-CHLORO-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID70151255

Created by admin on Sat Dec 16 10:56:45 UTC 2023 , Edited by admin on Sat Dec 16 10:56:45 UTC 2023

PRIMARY

FDA UNII

98P5L85D7T

Created by admin on Sat Dec 16 10:56:45 UTC 2023 , Edited by admin on Sat Dec 16 10:56:45 UTC 2023

PRIMARY

CAS

1159977-64-6

Created by admin on Sat Dec 16 10:56:45 UTC 2023 , Edited by admin on Sat Dec 16 10:56:45 UTC 2023

PRIMARY

PUBCHEM

46783272

Created by admin on Sat Dec 16 10:56:45 UTC 2023 , Edited by admin on Sat Dec 16 10:56:45 UTC 2023

PRIMARY

Related Record Type Details


					216X081ORU

ZIPRASIDONE HYDROCHLORIDE

PARENT -> IMPURITY


					3X6SAX83JZ

ZIPRASIDONE MESYLATE

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: