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Details

Stereochemistry ACHIRAL
Molecular Formula C13H21NO2S.ClH
Molecular Weight 291.837
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-TSB HYDROCHLORIDE

SMILES

Cl.CCOC1=CC(CCN)=CC(OCC)=C1SC

InChI

InChIKey=MJKJOKYFRUTLOF-UHFFFAOYSA-N
InChI=1S/C13H21NO2S.ClH/c1-4-15-11-8-10(6-7-14)9-12(16-5-2)13(11)17-3;/h8-9H,4-7,14H2,1-3H3;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 C13H21NO2S
Molecular Weight 255.376
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 13:53:19 GMT 2025
Edited
by admin
on Wed Apr 02 13:53:19 GMT 2025
Record UNII
MKB89ZZS7V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-TSB HYDROCHLORIDE
Common Name English
4-METHYLTHIO-3,5-DIETHOXY-PHENETHYLAMINE HYDROCHLORIDE
Preferred Name English
BENZENEETHANAMINE, 3,5-DIETHOXY-4-(METHYLTHIO)-, HYDROCHLORIDE
Systematic Name English
BENZENEETHANAMINE, 3,5-DIETHOXY-4-(METHYLTHIO)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
MKB89ZZS7V
Created by admin on Wed Apr 02 13:53:19 GMT 2025 , Edited by admin on Wed Apr 02 13:53:19 GMT 2025
PRIMARY
PUBCHEM
86250284
Created by admin on Wed Apr 02 13:53:19 GMT 2025 , Edited by admin on Wed Apr 02 13:53:19 GMT 2025
PRIMARY
CAS
90109-46-9
Created by admin on Wed Apr 02 13:53:19 GMT 2025 , Edited by admin on Wed Apr 02 13:53:19 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE