EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H8N2S |
| Net Charge | 0 |
| Average Mass | 212.277 |
| Monoisotopic Mass | 212.04082 |
| SMILES | c1ccc2sc(-c3ccncc3)nc2c1 |
| InChI | InChI=1S/C12H8N2S/c1-2-4-11-10(3-1)14-12(15-11)9-5-7-13-8-6-9/h1-8H |
| InChIKey | PDSIQRUYAXGTJG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-pyridin-4-yl-1,3-benzothiazole (CHEBI:120965) is a benzothiazoles (CHEBI:37947) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32408 | LINCS |