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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H5ClN2S
Molecular Weight 184.646
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-CHLORO-1,2-BENZISOTHIAZOL-7-AMINE

SMILES

NC1=CC=CC2=C1SN=C2Cl

InChI

InChIKey=QEMAADKFXFAFPL-UHFFFAOYSA-N
InChI=1S/C7H5ClN2S/c8-7-4-2-1-3-5(9)6(4)11-10-7/h1-3H,9H2

HIDE SMILES / InChI

Molecular Formula C7H5ClN2S
Molecular Weight 184.646
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 Mon Mar 31 22:20:37 GMT 2025
Edited
by admin
on Mon Mar 31 22:20:37 GMT 2025
Record UNII
FFV3BQ94EK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-CHLOROBENZO(D)ISOTHIAZOL-7-AMINE
Preferred Name English
3-CHLORO-1,2-BENZISOTHIAZOL-7-AMINE
Systematic Name English
1,2-BENZISOTHIAZOL-7-AMINE, 3-CHLORO-
Systematic Name English
Code System Code Type Description
CAS
148193-31-1
Created by admin on Mon Mar 31 22:20:37 GMT 2025 , Edited by admin on Mon Mar 31 22:20:37 GMT 2025
PRIMARY
EPA CompTox
DTXSID30163930
Created by admin on Mon Mar 31 22:20:37 GMT 2025 , Edited by admin on Mon Mar 31 22:20:37 GMT 2025
PRIMARY
PUBCHEM
198767
Created by admin on Mon Mar 31 22:20:37 GMT 2025 , Edited by admin on Mon Mar 31 22:20:37 GMT 2025
PRIMARY
FDA UNII
FFV3BQ94EK
Created by admin on Mon Mar 31 22:20:37 GMT 2025 , Edited by admin on Mon Mar 31 22:20:37 GMT 2025
PRIMARY