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Details

Stereochemistry RACEMIC
Molecular Formula C21H28N2OS
Molecular Weight 356.525
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Methylthiofentanyl, trans-

SMILES

CCC(=O)N([C@@H]1CCN(CCC2=CC=CS2)C[C@H]1C)C3=CC=CC=C3

InChI

InChIKey=SRARDYUHGVMEQI-YLJYHZDGSA-N
InChI=1S/C21H28N2OS/c1-3-21(24)23(18-8-5-4-6-9-18)20-12-14-22(16-17(20)2)13-11-19-10-7-15-25-19/h4-10,15,17,20H,3,11-14,16H2,1-2H3/t17-,20-/m1/s1

HIDE SMILES / InChI

Molecular Formula C21H28N2OS
Molecular Weight 356.525
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 19:48:49 GMT 2025
Edited
by admin
on Wed Apr 02 19:48:49 GMT 2025
Record UNII
FWY9B75YNQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(±)-trans-3-methyl Thiofentanyl
Preferred Name English
3-Methylthiofentanyl, trans-
Common Name English
trans-N-3-methyl-1-(2-(thiophen-2-yl)ethyl)piperidin-4-yl)-N-phenylpropionamide
Systematic Name English
Code System Code Type Description
CAS
2748623-39-2
Created by admin on Wed Apr 02 19:48:49 GMT 2025 , Edited by admin on Wed Apr 02 19:48:49 GMT 2025
PRIMARY
PUBCHEM
57468492
Created by admin on Wed Apr 02 19:48:49 GMT 2025 , Edited by admin on Wed Apr 02 19:48:49 GMT 2025
PRIMARY
FDA UNII
FWY9B75YNQ
Created by admin on Wed Apr 02 19:48:49 GMT 2025 , Edited by admin on Wed Apr 02 19:48:49 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT