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Details

Stereochemistry ACHIRAL
Molecular Formula C7H4ClNS
Molecular Weight 169.631
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Chloro-1,2-benzisothiazole

SMILES

ClC1=NSC2=C1C=CC=C2

InChI

InChIKey=BCPVKLRBQLRWDQ-UHFFFAOYSA-N
InChI=1S/C7H4ClNS/c8-7-5-3-1-2-4-6(5)10-9-7/h1-4H

HIDE SMILES / InChI

Molecular Formula C7H4ClNS
Molecular Weight 169.631
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 21:09:37 GMT 2025
Edited
by admin
on Wed Apr 02 21:09:37 GMT 2025
Record UNII
7QAF6LPY33
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2-Benzisothiazole, 3-chloro-
Preferred Name English
3-Chloro-1,2-benzisothiazole
Systematic Name English
Code System Code Type Description
CAS
7716-66-7
Created by admin on Wed Apr 02 21:09:37 GMT 2025 , Edited by admin on Wed Apr 02 21:09:37 GMT 2025
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FDA UNII
7QAF6LPY33
Created by admin on Wed Apr 02 21:09:37 GMT 2025 , Edited by admin on Wed Apr 02 21:09:37 GMT 2025
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EPA CompTox
DTXSID20344599
Created by admin on Wed Apr 02 21:09:37 GMT 2025 , Edited by admin on Wed Apr 02 21:09:37 GMT 2025
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PUBCHEM
598190
Created by admin on Wed Apr 02 21:09:37 GMT 2025 , Edited by admin on Wed Apr 02 21:09:37 GMT 2025
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