XANTHIOL

Details

Stereochemistry	RACEMIC
Molecular Formula	C23H29ClN2OS
Molecular Weight	417.007
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OCCCN1CCN(CCCC2C3=C(SC4=C2C=C(Cl)C=C4)C=CC=C3)CC1

InChI

InChIKey=VQLAZPRVCPICCQ-UHFFFAOYSA-N

InChI=1S/C23H29ClN2OS/c24-18-8-9-23-21(17-18)19(20-5-1-2-7-22(20)28-23)6-3-10-25-12-14-26(15-13-25)11-4-16-27/h1-2,5,7-9,17,19,27H,3-4,6,10-16H2

HIDE SMILES / InChI

Molecular Formula	C23H29ClN2OS
Molecular Weight	417.007
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Description
Sources: https://www.jstage.jst.go.jp/article/cpb1958/35/6/35_6_2545/_pdf | https://www.ncbi.nlm.nih.gov/pubmed/1208553

XANTHIOL, a thioxanthene derivative, is a neuroleptic. Phenothiazine nucleus may be replaced by xanthiol without greatly altering the effects upon psychotic symptomatology.

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:23:13 GMT 2023` Edited by `admin` on `Fri Dec 15 15:23:13 GMT 2023`
Record UNII	MDW4J03B3Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

XANTHIOL

Official Name

English

xanthiol [INN]

Common Name

English

4-(3-(2-CHLORO-9H-THIOXANTHEN-9-YL)PROPYL)-1-PIPERAZINE-1-PROPANOL

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29707