EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H15N3O2S2 |
| Net Charge | 0 |
| Average Mass | 357.460 |
| Monoisotopic Mass | 357.06057 |
| SMILES | COc1ccc(OCCSc2nnc3sc4ccccc4n23)cc1 |
| InChI | InChI=1S/C17H15N3O2S2/c1-21-12-6-8-13(9-7-12)22-10-11-23-16-18-19-17-20(16)14-4-2-3-5-15(14)24-17/h2-9H,10-11H2,1H3 |
| InChIKey | CFGZDYLHKGUMKS-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[2-(4-methoxyphenoxy)ethylthio]-[1,2,4]triazolo[3,4-b][1,3]benzothiazole (CHEBI:109575) is a triazolobenzothiazole (CHEBI:48908) |
| Manual Xrefs | Databases |
|---|---|
| LSM-21003 | LINCS |