U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C23H29ClN2OS.2ClH
Molecular Weight 489.929
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of XANTHIOL HYDROCHLORIDE

SMILES

Cl.Cl.OCCCN1CCN(CCCC2C3=CC=CC=C3SC4=CC=C(Cl)C=C24)CC1

InChI

InChIKey=WCSMSWYAHBNGDC-UHFFFAOYSA-N
InChI=1S/C23H29ClN2OS.2ClH/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;2*1H

HIDE SMILES / InChI
Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE
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

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

Approval Year

Unknown
149124
Substance Class Chemical
Created
by admin
on Mon Mar 31 17:34:33 GMT 2025
Edited
by admin
on Mon Mar 31 17:34:33 GMT 2025
Record UNII
DY0Q615ZBN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
XANTHIOL HYDROCHLORIDE
Common Name English
NSC-78224
Preferred Name English
4-(3-(2-CHLORO-9H-THIOXANTHEN-9-YL)PROPYL)-1-PIPERAZINEPROPANOL DIHYDROCHLORIDE
Systematic Name English
XANTHIOL HCL
Common Name English
Code System Code Type Description
FDA UNII
DY0Q615ZBN
Created by admin on Mon Mar 31 17:34:33 GMT 2025 , Edited by admin on Mon Mar 31 17:34:33 GMT 2025
PRIMARY
NSC
78224
Created by admin on Mon Mar 31 17:34:33 GMT 2025 , Edited by admin on Mon Mar 31 17:34:33 GMT 2025
PRIMARY
PUBCHEM
28360
Created by admin on Mon Mar 31 17:34:33 GMT 2025 , Edited by admin on Mon Mar 31 17:34:33 GMT 2025
PRIMARY
CAS
17162-32-2
Created by admin on Mon Mar 31 17:34:33 GMT 2025 , Edited by admin on Mon Mar 31 17:34:33 GMT 2025
PRIMARY
Related Record Type Details
Structure of XANTHIOL
PARENT -> SALT/SOLVATE
Related Record Type Details
Structure of XANTHIOL
ACTIVE MOIETY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966