10-(3-(4.BETA.-DIMETHYLCARBAMYLOXYETHYL-1-PIPERAZINYL)PROPYL)-2-ACETYLPHENOTHIAZINE DIMALEATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H34N4O3S.2C4H4O4
Molecular Weight	714.782
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of 10-(3-(4.BETA.-DIMETHYLCARBAMYLOXYETHYL-1-PIPERAZINYL)PROPYL)-2-ACETYLPHENOTHIAZINE DIMALEATE

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.OC(=O)\C=C/C(O)=O.CN(C)C(=O)OCCN1CCN(CCCN2C3=CC(=CC=C3SC4=C2C=CC=C4)C(C)=O)CC1

InChI

InChIKey=NZNAXBKCVUQWJH-SPIKMXEPSA-N

InChI=1S/C26H34N4O3S.2C4H4O4/c1-20(31)21-9-10-25-23(19-21)30(22-7-4-5-8-24(22)34-25)12-6-11-28-13-15-29(16-14-28)17-18-33-26(32)27(2)3;2*5-3(6)1-2-4(7)8/h4-5,7-10,19H,6,11-18H2,1-3H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-

HIDE SMILES / InChI

Molecular Formula	C26H34N4O3S
Molecular Weight	482.638
Charge	0
Count

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

Molecular Formula	C4H4O4
Molecular Weight	116.0722
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 06:45:00 GMT 2023` Edited by `admin` on `Sat Dec 16 06:45:00 GMT 2023`
Record UNII	T538NI0F92
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

10-(3-(4.BETA.-DIMETHYLCARBAMYLOXYETHYL-1-PIPERAZINYL)PROPYL)-2-ACETYLPHENOTHIAZINE DIMALEATE

Systematic Name

English

CARBAMIC ACID, DIMETHYL-, 2-(4-(3-(2-ACETYL-10H-PHENOTHIAZIN-10-YL)PROPYL)-1-PIPERAZINYL)ETHYL ESTER, (2Z)-2-BUTENEDIOATE (1:2)

Systematic Name

English

Code System Code Type Description

FDA UNII

T538NI0F92

Created by admin on Sat Dec 16 06:45:00 GMT 2023 , Edited by admin on Sat Dec 16 06:45:00 GMT 2023

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EPA CompTox

DTXSID90274935

Created by admin on Sat Dec 16 06:45:00 GMT 2023 , Edited by admin on Sat Dec 16 06:45:00 GMT 2023

PRIMARY

PUBCHEM

133082895

Created by admin on Sat Dec 16 06:45:00 GMT 2023 , Edited by admin on Sat Dec 16 06:45:00 GMT 2023

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CAS

23294-24-8

Created by admin on Sat Dec 16 06:45:00 GMT 2023 , Edited by admin on Sat Dec 16 06:45:00 GMT 2023

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