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Details

Stereochemistry RACEMIC
Molecular Formula C18H20ClNOS
Molecular Weight 333.876
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

SMILES

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

InChI

InChIKey=YJINNJOMTOJZBH-UHFFFAOYSA-N
InChI=1S/C18H20ClNOS/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

HIDE SMILES / InChI

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 Sat Dec 16 19:54:20 GMT 2023
Edited
by admin
on Sat Dec 16 19:54:20 GMT 2023
Record UNII
EH6QRW2BNE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Chloro-9-[3-(dimethylamino)propyl]-9H-thioxanthen-9-ol
Systematic Name English
9H-Thioxanthen-9-ol, 2-chloro-9-[3-(dimethylamino)propyl]-
Systematic Name English
Chlorprothixene Hydrochloride Impurity A [Ep Impurity]
Common Name English
Thioxanthen-9-ol, 2-chloro-9-[3-(dimethylamino)propyl]
Systematic Name English
2-chloro-9-[3-(dimethylamino)propyl]-9-thioxanthenol
Systematic Name English
(3RS)-2-chloro-9-[3-(dimethylamino)propyl]-9H-thioxanthen-9-ol
Systematic Name English
Code System Code Type Description
FDA UNII
EH6QRW2BNE
Created by admin on Sat Dec 16 19:54:20 GMT 2023 , Edited by admin on Sat Dec 16 19:54:20 GMT 2023
PRIMARY
PUBCHEM
107255
Created by admin on Sat Dec 16 19:54:20 GMT 2023 , Edited by admin on Sat Dec 16 19:54:20 GMT 2023
PRIMARY
CAS
4295-65-2
Created by admin on Sat Dec 16 19:54:20 GMT 2023 , Edited by admin on Sat Dec 16 19:54:20 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY