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Details

Stereochemistry ACHIRAL
Molecular Formula C16H24N3OS
Molecular Weight 306.446
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

SHOW SMILES / InChI
Structure of 1-Methyl-3-[4-(octyloxy)-1,2,5-thiadiazol-3-yl]pyridinium

SMILES

CCCCCCCCOC1=NSN=C1C2=CC=C[N+](C)=C2

InChI

InChIKey=VKAZSCUTMHOVAV-UHFFFAOYSA-N
InChI=1S/C16H24N3OS/c1-3-4-5-6-7-8-12-20-16-15(17-21-18-16)14-10-9-11-19(2)13-14/h9-11,13H,3-8,12H2,1-2H3/q+1

HIDE SMILES / InChI

Molecular Formula C16H24N3OS
Molecular Weight 306.446
Charge 1
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 18:42:32 GMT 2025
Edited
by admin
on Wed Apr 02 18:42:32 GMT 2025
Record UNII
4Q8TAF5WVG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Pyridinium, 1-methyl-3-[4-(octyloxy)-1,2,5-thiadiazol-3-yl]-
Preferred Name English
1-Methyl-3-[4-(octyloxy)-1,2,5-thiadiazol-3-yl]pyridinium
Systematic Name English
Code System Code Type Description
CAS
780005-39-2
Created by admin on Wed Apr 02 18:42:32 GMT 2025 , Edited by admin on Wed Apr 02 18:42:32 GMT 2025
PRIMARY
FDA UNII
4Q8TAF5WVG
Created by admin on Wed Apr 02 18:42:32 GMT 2025 , Edited by admin on Wed Apr 02 18:42:32 GMT 2025
PRIMARY
PUBCHEM
19075405
Created by admin on Wed Apr 02 18:42:32 GMT 2025 , Edited by admin on Wed Apr 02 18:42:32 GMT 2025
PRIMARY