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Details

Stereochemistry RACEMIC
Molecular Formula C18H20ClNOS.ClH
Molecular Weight 370.336
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Chloro-9-[3-(dimethylamino)propyl]-9H-thioxanthen-9-ol hydrochloride

SMILES

Cl.CN(C)CCCC1(O)C2=CC=CC=C2SC3=CC=C(Cl)C=C13

InChI

InChIKey=KPOJDNMFVYMKCD-UHFFFAOYSA-N
InChI=1S/C18H20ClNOS.ClH/c1-20(2)11-5-10-18(21)14-6-3-4-7-16(14)22-17-9-8-13(19)12-15(17)18;/h3-4,6-9,12,21H,5,10-11H2,1-2H3;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 C18H20ClNOS
Molecular Weight 333.876
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 17:57:32 GMT 2025
Edited
by admin
on Wed Apr 02 17:57:32 GMT 2025
Record UNII
YK5AJY59YQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Chloro-9-[3-(dimethylamino)propyl]-9H-thioxanthen-9-ol hydrochloride
Systematic Name English
9H-Thioxanthen-9-ol, 2-chloro-9-[3-(dimethylamino)propyl]-, hydrochloride (1:1)
Preferred Name English
Thioxanthen-9-ol, 2-chloro-9-[3-(dimethylamino)propyl]-, hydrochloride
Systematic Name English
Code System Code Type Description
FDA UNII
YK5AJY59YQ
Created by admin on Wed Apr 02 17:57:32 GMT 2025 , Edited by admin on Wed Apr 02 17:57:32 GMT 2025
PRIMARY
PUBCHEM
171390034
Created by admin on Wed Apr 02 17:57:32 GMT 2025 , Edited by admin on Wed Apr 02 17:57:32 GMT 2025
PRIMARY
CAS
93946-73-7
Created by admin on Wed Apr 02 17:57:32 GMT 2025 , Edited by admin on Wed Apr 02 17:57:32 GMT 2025
PRIMARY
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