(2Z)-4-(3,4-DICHLOROPHENYL)-2-((5-HYDROXY-2-(4-METHYL-1-PIPERAZINYL)PHENYL)METHYLENE)-3-THIOMORPHOLINONE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H23Cl2N3O2S
Molecular Weight	464.408
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of (2Z)-4-(3,4-DICHLOROPHENYL)-2-((5-HYDROXY-2-(4-METHYL-1-PIPERAZINYL)PHENYL)METHYLENE)-3-THIOMORPHOLINONE

Structure Search

SMILES

CN1CCN(CC1)C2=CC=C(O)C=C2\C=C3/SCCN(C3=O)C4=CC(Cl)=C(Cl)C=C4

InChI

InChIKey=PCICWUSZYZLXID-BKUYFWCQSA-N

InChI=1S/C22H23Cl2N3O2S/c1-25-6-8-26(9-7-25)20-5-3-17(28)12-15(20)13-21-22(29)27(10-11-30-21)16-2-4-18(23)19(24)14-16/h2-5,12-14,28H,6-11H2,1H3/b21-13-

HIDE SMILES / InChI

Molecular Formula	C22H23Cl2N3O2S
Molecular Weight	464.408
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 16:32:21 GMT 2023` Edited by `admin` on `Sat Dec 16 16:32:21 GMT 2023`
Record UNII	DMT4KZK6LQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(2Z)-4-(3,4-DICHLOROPHENYL)-2-((5-HYDROXY-2-(4-METHYL-1-PIPERAZINYL)PHENYL)METHYLENE)-3-THIOMORPHOLINONE

Systematic Name

English

ELZASONAN METABOLITE M3

Common Name

English

3-THIOMORPHOLINONE, 4-(3,4-DICHLOROPHENYL)-2-((5-HYDROXY-2-(4-METHYL-1-PIPERAZINYL)PHENYL)METHYLENE)-, (2Z)-

Systematic Name

English

Code System Code Type Description

FDA UNII

DMT4KZK6LQ

Created by admin on Sat Dec 16 16:32:22 GMT 2023 , Edited by admin on Sat Dec 16 16:32:22 GMT 2023

PRIMARY

CAS

1809096-97-6

Created by admin on Sat Dec 16 16:32:22 GMT 2023 , Edited by admin on Sat Dec 16 16:32:22 GMT 2023

PRIMARY

PUBCHEM

11719626

Created by admin on Sat Dec 16 16:32:22 GMT 2023 , Edited by admin on Sat Dec 16 16:32:22 GMT 2023

PRIMARY

Related Record Type Details


					933PJL964R

ELZASONAN

PARENT -> METABOLITE

Qualification:

FECAL

Amount: