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

Details

Stereochemistry ACHIRAL
Molecular Formula C16H10N2O2S
Molecular Weight 294.328
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(6-OXO-6H-ANTHRA(9,1-CD)ISOTHIAZOL-7-YL)ACETAMIDE

SMILES

CC(=O)NC1=C2C(=O)C3=CC=CC4=C3C(=NS4)C2=CC=C1

InChI

InChIKey=JNJWDMRFGGSELJ-UHFFFAOYSA-N
InChI=1S/C16H10N2O2S/c1-8(19)17-11-6-2-4-9-13(11)16(20)10-5-3-7-12-14(10)15(9)18-21-12/h2-7H,1H3,(H,17,19)

HIDE SMILES / InChI

Approval Year

Name Type Language
ACETAMIDE, N-(6-OXO-6H-ANTHRA(9,1-CD)ISOTHIAZOL-7-YL)-
Preferred Name English
N-(6-OXO-6H-ANTHRA(9,1-CD)ISOTHIAZOL-7-YL)ACETAMIDE
Systematic Name English
Code System Code Type Description
CAS
50988-01-7
Created by admin on Tue Apr 01 19:14:07 GMT 2025 , Edited by admin on Tue Apr 01 19:14:07 GMT 2025
PRIMARY
ECHA (EC/EINECS)
256-896-0
Created by admin on Tue Apr 01 19:14:07 GMT 2025 , Edited by admin on Tue Apr 01 19:14:07 GMT 2025
PRIMARY
PUBCHEM
6452318
Created by admin on Tue Apr 01 19:14:07 GMT 2025 , Edited by admin on Tue Apr 01 19:14:07 GMT 2025
PRIMARY
EPA CompTox
DTXSID50198986
Created by admin on Tue Apr 01 19:14:07 GMT 2025 , Edited by admin on Tue Apr 01 19:14:07 GMT 2025
PRIMARY
FDA UNII
RW4LN45N94
Created by admin on Tue Apr 01 19:14:07 GMT 2025 , Edited by admin on Tue Apr 01 19:14:07 GMT 2025
PRIMARY