CLOTHIXAMIDE MALEATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C24H28ClN3OS.2C4H4O4
Molecular Weight	674.161
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	3
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)\C=C/C(O)=O.OC(=O)\C=C/C(O)=O.CNC(=O)CCN1CCN(CCC=C2C3=CC(Cl)=CC=C3SC4=C2C=CC=C4)CC1

InChI

InChIKey=PDAUESICMCKTDM-SPIKMXEPSA-N

InChI=1S/C24H28ClN3OS.2C4H4O4/c1-26-24(29)10-12-28-15-13-27(14-16-28)11-4-6-19-20-5-2-3-7-22(20)30-23-9-8-18(25)17-21(19)23;2*5-3(6)1-2-4(7)8/h2-3,5-9,17H,4,10-16H2,1H3,(H,26,29);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-

HIDE SMILES / InChI

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

Molecular Formula	C24H28ClN3OS
Molecular Weight	442.017
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 `Fri Dec 15 14:58:36 GMT 2023` Edited by `admin` on `Fri Dec 15 14:58:36 GMT 2023`
Record UNII	DNS84NJF1Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CLOTHIXAMIDE MALEATE

Official Name

English

1-PIPERAZINEPROPANAMIDE, 4-(3-(2-CHLORO-9H-THIOXANTHEN-9-YLIDENE)PROPYL)-N-METHYL-, (Z)-2-BUTENEDIOATE (1:2)

Systematic Name

English

P-4385B

Code

English

CLOTHIXAMIDE MALEATE [USAN]

Common Name

English

NSC-78714

Code

English

4-[3-(2-Chlorothioxanthen-9-ylidene)propyl]-N-methyl-1-piperazinepropionamide maleate (1:2)

Systematic Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29710