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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7ClN3S.I
Molecular Weight 339.584
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(4-chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridin-1-ium iodide

SMILES

[I-].C[N+]1=CC=CC(=C1)C2=NSN=C2Cl

InChI

InChIKey=SKDWFKQVJIGJCO-UHFFFAOYSA-M
InChI=1S/C8H7ClN3S.HI/c1-12-4-2-3-6(5-12)7-8(9)11-13-10-7;/h2-5H,1H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula I
Molecular Weight 126.9045
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C8H7ClN3S
Molecular Weight 212.679
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 Sat Dec 16 20:12:58 GMT 2023
Edited
by admin
on Sat Dec 16 20:12:58 GMT 2023
Record UNII
SR2EDL796J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(4-chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridin-1-ium iodide
Systematic Name English
3-(4-Chloro-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodide
Systematic Name English
Pyridinium, 3-(4-chloro-1,2,5-thiadiazol-3-yl)-1-methyl-, iodide (1:1)
Systematic Name English
Pyridinium, 3-(4-chloro-1,2,5-thiadiazol-3-yl)-1-methyl-, iodide
Systematic Name English
Code System Code Type Description
FDA UNII
SR2EDL796J
Created by admin on Sat Dec 16 20:12:58 GMT 2023 , Edited by admin on Sat Dec 16 20:12:58 GMT 2023
PRIMARY
PUBCHEM
19075334
Created by admin on Sat Dec 16 20:12:58 GMT 2023 , Edited by admin on Sat Dec 16 20:12:58 GMT 2023
PRIMARY
CAS
131988-25-5
Created by admin on Sat Dec 16 20:12:58 GMT 2023 , Edited by admin on Sat Dec 16 20:12:58 GMT 2023
PRIMARY