U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C13H18N3OS
Molecular Weight 264.367
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 1

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

SMILES

CCCCCOC1=NSN=C1C2=C[N+](C)=CC=C2

InChI

InChIKey=ACZCTVOLCLHPTG-UHFFFAOYSA-N
InChI=1S/C13H18N3OS/c1-3-4-5-9-17-13-12(14-18-15-13)11-7-6-8-16(2)10-11/h6-8,10H,3-5,9H2,1-2H3/q+1

HIDE SMILES / InChI

Approval Year

Name Type Language
1-Methyl-3-[4-(pentyloxy)-1,2,5-thiadiazol-3-yl]pyridinium
Systematic Name English
Code System Code Type Description
CAS
749175-57-3
Created by admin on Sat Dec 16 20:06:07 GMT 2023 , Edited by admin on Sat Dec 16 20:06:07 GMT 2023
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FDA UNII
76FXV6YW7R
Created by admin on Sat Dec 16 20:06:07 GMT 2023 , Edited by admin on Sat Dec 16 20:06:07 GMT 2023
PRIMARY
PUBCHEM
19075503
Created by admin on Sat Dec 16 20:06:07 GMT 2023 , Edited by admin on Sat Dec 16 20:06:07 GMT 2023
PRIMARY