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Details

Stereochemistry ACHIRAL
Molecular Formula C14H23NO2S
Molecular Weight 269.403
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of THIOBUSCALINE

SMILES

CCCCSC1=C(OC)C=C(CCN)C=C1OC

InChI

InChIKey=CPNWMHCBHUXITO-UHFFFAOYSA-N
InChI=1S/C14H23NO2S/c1-4-5-8-18-14-12(16-2)9-11(6-7-15)10-13(14)17-3/h9-10H,4-8,15H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C14H23NO2S
Molecular Weight 269.403
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 08:39:20 GMT 2025
Edited
by admin
on Wed Apr 02 08:39:20 GMT 2025
Record UNII
45ZTS7GX2F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TB (PSYCHEDELIC)
Preferred Name English
THIOBUSCALINE
Common Name English
3,5-DIMETHOXY-4-BUTYLTHIOPHENETHYLAMINE
Systematic Name English
2-(4-(BUTYLTHIO)-3,5-DIMETHOXYPHENYL)ETHANAMINE
Systematic Name English
BENZENEETHANAMINE, 4-(BUTYLTHIO)-3,5-DIMETHOXY-
Systematic Name English
4-(BUTYLTHIO)-3,5-DIMETHOXYBENZENEETHANAMINE
Systematic Name English
Classification Tree Code System Code
WIKIPEDIA PiHKAL
Created by admin on Wed Apr 02 08:39:20 GMT 2025 , Edited by admin on Wed Apr 02 08:39:20 GMT 2025
Code System Code Type Description
PUBCHEM
44349865
Created by admin on Wed Apr 02 08:39:20 GMT 2025 , Edited by admin on Wed Apr 02 08:39:20 GMT 2025
PRIMARY
CAS
90109-57-2
Created by admin on Wed Apr 02 08:39:20 GMT 2025 , Edited by admin on Wed Apr 02 08:39:20 GMT 2025
PRIMARY
FDA UNII
45ZTS7GX2F
Created by admin on Wed Apr 02 08:39:20 GMT 2025 , Edited by admin on Wed Apr 02 08:39:20 GMT 2025
PRIMARY
EPA CompTox
DTXSID80658366
Created by admin on Wed Apr 02 08:39:20 GMT 2025 , Edited by admin on Wed Apr 02 08:39:20 GMT 2025
PRIMARY
WIKIPEDIA
Thiobuscaline
Created by admin on Wed Apr 02 08:39:20 GMT 2025 , Edited by admin on Wed Apr 02 08:39:20 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY