ZIPRASIDONE SULFOXIDE

Details

Stereochemistry	RACEMIC
Molecular Formula	C21H21ClN4O2S
Molecular Weight	428.935
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[O-][S+]1N=C(N2CCN(CCC3=CC4=C(NC(=O)C4)C=C3Cl)CC2)C5=C1C=CC=C5

InChI

InChIKey=XYYQWGUKBVTGJQ-UHFFFAOYSA-N

InChI=1S/C21H21ClN4O2S/c22-17-13-18-15(12-20(27)23-18)11-14(17)5-6-25-7-9-26(10-8-25)21-16-3-1-2-4-19(16)29(28)24-21/h1-4,11,13H,5-10,12H2,(H,23,27)

HIDE SMILES / InChI

Molecular Formula	C21H21ClN4O2S
Molecular Weight	428.935
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 19:10:35 GMT 2023` Edited by `admin` on `Sat Dec 16 19:10:35 GMT 2023`
Record UNII	5VV7CA4473
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ZIPRASIDONE SULFOXIDE

Common Name

English

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

Systematic Name

English

ZIPRASIDONE (M10)

Common Name

English

Code System Code Type Description

FDA UNII

5VV7CA4473

Created by admin on Sat Dec 16 19:10:35 GMT 2023 , Edited by admin on Sat Dec 16 19:10:35 GMT 2023

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CAS

188797-80-0

Created by admin on Sat Dec 16 19:10:35 GMT 2023 , Edited by admin on Sat Dec 16 19:10:35 GMT 2023

PRIMARY

PUBCHEM

15959407

Created by admin on Sat Dec 16 19:10:35 GMT 2023 , Edited by admin on Sat Dec 16 19:10:35 GMT 2023

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EPA CompTox

DTXSID90580482

Created by admin on Sat Dec 16 19:10:35 GMT 2023 , Edited by admin on Sat Dec 16 19:10:35 GMT 2023

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Related Record Type Details


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ZIPRASIDONE

PARENT -> METABOLITE

Interaction Type:

MAJOR