Lurasidone Piperazine N-Oxide

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H36N4O3S
Molecular Weight	508.675
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Lurasidone Piperazine N-Oxide

Structure Search

SMILES

[O-][N+]5(C[C@@H]1CCCC[C@H]1CN2C(=O)[C@H]3[C@@H]4CC[C@@H](C4)[C@H]3C2=O)CCN(CC5)C6=NSC7=C6C=CC=C7

InChI

InChIKey=HFNFEWDWVQOXRX-CVTJIBDQSA-N

InChI=1S/C28H36N4O3S/c33-27-24-18-9-10-19(15-18)25(24)28(34)31(27)16-20-5-1-2-6-21(20)17-32(35)13-11-30(12-14-32)26-22-7-3-4-8-23(22)36-29-26/h3-4,7-8,18-21,24-25H,1-2,5-6,9-17H2/t18-,19+,20-,21-,24+,25-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C28H36N4O3S
Molecular Weight	508.675
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 21:07:16 GMT 2025` Edited by `admin` on `Wed Apr 02 21:07:16 GMT 2025`
Record UNII	GUM9ZG3U8P
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

(3aR,4S,7R,7aS)-2-[[(1R,2R)-2-[[4-(1,2-Benzisothiazol-3-yl)-1-oxido-1-piperazinyl]methyl]cyclohexyl]methyl]hexahydro-4,7-methano-1H-isoindole-1,3(2H)-dione

Preferred Name

English

Lurasidone Piperazine N-Oxide

Common Name

English

4,7-Methano-1H-isoindole-1,3(2H)-dione, 2-[[(1R,2R)-2-[[4-(1,2-benzisothiazol-3-yl)-1-oxido-1-piperazinyl]methyl]cyclohexyl]methyl]hexahydro-, (3aR,4S,7R,7aS)-

Systematic Name

English

Code System Code Type Description

CAS

1574569-32-6

Created by admin on Wed Apr 02 21:07:16 GMT 2025 , Edited by admin on Wed Apr 02 21:07:16 GMT 2025

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PUBCHEM

89994627

Created by admin on Wed Apr 02 21:07:16 GMT 2025 , Edited by admin on Wed Apr 02 21:07:16 GMT 2025

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FDA UNII

GUM9ZG3U8P

Created by admin on Wed Apr 02 21:07:16 GMT 2025 , Edited by admin on Wed Apr 02 21:07:16 GMT 2025

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