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Details

Stereochemistry ACHIRAL
Molecular Formula C17H15ClN2O3S
Molecular Weight 362.831
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (4-CHLOROPHENYL)CARBAMIC ACID 3-(3-OXO-1,2-BENZISOTHIAZOL-2(3H)-YL)PROPYL ESTER

SMILES

ClC1=CC=C(NC(=O)OCCCN2SC3=C(C=CC=C3)C2=O)C=C1

InChI

InChIKey=TXMQOQKECRSTSS-UHFFFAOYSA-N
InChI=1S/C17H15ClN2O3S/c18-12-6-8-13(9-7-12)19-17(22)23-11-3-10-20-16(21)14-4-1-2-5-15(14)24-20/h1-2,4-9H,3,10-11H2,(H,19,22)

HIDE SMILES / InChI

Molecular Formula C17H15ClN2O3S
Molecular Weight 362.831
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 23:19:35 GMT 2025
Edited
by admin
on Mon Mar 31 23:19:35 GMT 2025
Record UNII
79DV79OLN0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(4-CHLOROPHENYL)CARBAMIC ACID 3-(3-OXO-1,2-BENZISOTHIAZOL-2(3H)-YL)PROPYL ESTER
Systematic Name English
CARBAMIC ACID, (4-CHLOROPHENYL)-, 3-(3-OXO-1,2-BENZISOTHIAZOL-2(3H)-YL)PROPYL ESTER
Preferred Name English
Code System Code Type Description
EPA CompTox
DTXSID50941813
Created by admin on Mon Mar 31 23:19:35 GMT 2025 , Edited by admin on Mon Mar 31 23:19:35 GMT 2025
PRIMARY
PUBCHEM
10713716
Created by admin on Mon Mar 31 23:19:35 GMT 2025 , Edited by admin on Mon Mar 31 23:19:35 GMT 2025
PRIMARY
FDA UNII
79DV79OLN0
Created by admin on Mon Mar 31 23:19:35 GMT 2025 , Edited by admin on Mon Mar 31 23:19:35 GMT 2025
PRIMARY
CAS
199172-95-7
Created by admin on Mon Mar 31 23:19:35 GMT 2025 , Edited by admin on Mon Mar 31 23:19:35 GMT 2025
PRIMARY