EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H9N3S |
| Net Charge | 0 |
| Average Mass | 251.314 |
| Monoisotopic Mass | 251.05172 |
| SMILES | c1ccc2nc(-c3nc4ccccc4s3)nc2c1 |
| InChI | InChI=1S/C14H9N3S/c1-2-6-10-9(5-1)15-13(16-10)14-17-11-7-3-4-8-12(11)18-14/h1-8H,(H,15,16) |
| InChIKey | IIBOKVBFKUNLNA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(1H-benzimidazol-2-yl)-1,3-benzothiazole (CHEBI:94130) is a benzothiazoles (CHEBI:37947) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4740 | LINCS |