CHEBI:80776 - S 1319

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name S 1319
ChEBI ID CHEBI:80776
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C10H12N2O3S
Net Charge 0
Average Mass 240.27900
Monoisotopic Mass 240.05686
InChI InChI=1S/C10H12N2O3S/c1-11-4-7(14)5-2-3-6(13)8-9(5)16-10(15)12-8/h2-3,7,11,13-14H,4H2,1H3,(H,12,15)
InChIKey AWWPNKWNJLNEKN-UHFFFAOYSA-N
SMILES CNCC(O)c1ccc(O)c2[nH]c(=O)sc12
ChEBI Ontology
Outgoing S 1319 (CHEBI:80776) is a benzothiazoles (CHEBI:37947)
Manual Xref Database
C16880 KEGG COMPOUND
View more database links
Registry Number Type Source
220752-37-4 CAS Registry Number KEGG COMPOUND