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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H4ClNS2
Molecular Weight 201.696
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-CHLOROBENZOTHIAZOLE-2-THIOL

SMILES

ClC1=CC=C2NC(=S)SC2=C1

InChI

InChIKey=CLHLOHAQAADLRA-UHFFFAOYSA-N
InChI=1S/C7H4ClNS2/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)

HIDE SMILES / InChI

Molecular Formula C7H4ClNS2
Molecular Weight 201.696
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 Sat Dec 16 12:17:25 GMT 2023
Edited
by admin
on Sat Dec 16 12:17:25 GMT 2023
Record UNII
WX5R4MS85K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-CHLOROBENZOTHIAZOLE-2-THIOL
Systematic Name English
6-CHLORO-2-MERCAPTOBENZOTHIAZOLE
Common Name English
6-CHLORO-2(3H)-BENZOTHIAZOLETHIONE
Systematic Name English
NSC-503425
Code English
2(3H)-BENZOTHIAZOLETHIONE, 6-CHLORO-
Systematic Name English
BENZOTHIAZOLE, 6-CHLORO-2-MERCAPTO-
Common Name English
Code System Code Type Description
FDA UNII
WX5R4MS85K
Created by admin on Sat Dec 16 12:17:25 GMT 2023 , Edited by admin on Sat Dec 16 12:17:25 GMT 2023
PRIMARY
PUBCHEM
3034649
Created by admin on Sat Dec 16 12:17:25 GMT 2023 , Edited by admin on Sat Dec 16 12:17:25 GMT 2023
PRIMARY
CAS
51618-29-2
Created by admin on Sat Dec 16 12:17:25 GMT 2023 , Edited by admin on Sat Dec 16 12:17:25 GMT 2023
PRIMARY
ECHA (EC/EINECS)
257-321-6
Created by admin on Sat Dec 16 12:17:25 GMT 2023 , Edited by admin on Sat Dec 16 12:17:25 GMT 2023
PRIMARY
EPA CompTox
DTXSID20199561
Created by admin on Sat Dec 16 12:17:25 GMT 2023 , Edited by admin on Sat Dec 16 12:17:25 GMT 2023
PRIMARY
NSC
503425
Created by admin on Sat Dec 16 12:17:25 GMT 2023 , Edited by admin on Sat Dec 16 12:17:25 GMT 2023
PRIMARY