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Details

Stereochemistry ACHIRAL
Molecular Formula C20H19ClN2O4S3
Molecular Weight 483.024
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of S-(5-((P-CHLOROANILINO)SULFONYL)BENZOTHIAZOL-2-YL) O-CYCLOHEXYL THIOCARBONATE

SMILES

ClC1=CC=C(NS(=O)(=O)C2=CC3=C(SC(SC(=O)OC4CCCCC4)=N3)C=C2)C=C1

InChI

InChIKey=WKRUUBJGVXQZJR-UHFFFAOYSA-N
InChI=1S/C20H19ClN2O4S3/c21-13-6-8-14(9-7-13)23-30(25,26)16-10-11-18-17(12-16)22-19(28-18)29-20(24)27-15-4-2-1-3-5-15/h6-12,15,23H,1-5H2

HIDE SMILES / InChI

Molecular Formula C20H19ClN2O4S3
Molecular Weight 483.024
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 Tue Apr 01 19:05:14 GMT 2025
Edited
by admin
on Tue Apr 01 19:05:14 GMT 2025
Record UNII
0JHR1Z7ENZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CARBONOTHIOIC ACID, S-(5-(((4-CHLOROPHENYL)AMINO)SULFONYL)-2-BENZOTHIAZOLYL) O-CYCLOHEXYL ESTER
Preferred Name English
S-(5-((P-CHLOROANILINO)SULFONYL)BENZOTHIAZOL-2-YL) O-CYCLOHEXYL THIOCARBONATE
Systematic Name English
Code System Code Type Description
FDA UNII
0JHR1Z7ENZ
Created by admin on Tue Apr 01 19:05:14 GMT 2025 , Edited by admin on Tue Apr 01 19:05:14 GMT 2025
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CAS
94213-18-0
Created by admin on Tue Apr 01 19:05:14 GMT 2025 , Edited by admin on Tue Apr 01 19:05:14 GMT 2025
PRIMARY
PUBCHEM
56841358
Created by admin on Tue Apr 01 19:05:14 GMT 2025 , Edited by admin on Tue Apr 01 19:05:14 GMT 2025
PRIMARY
EPA CompTox
DTXSID90241046
Created by admin on Tue Apr 01 19:05:14 GMT 2025 , Edited by admin on Tue Apr 01 19:05:14 GMT 2025
PRIMARY
ECHA (EC/EINECS)
303-720-6
Created by admin on Tue Apr 01 19:05:14 GMT 2025 , Edited by admin on Tue Apr 01 19:05:14 GMT 2025
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