EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H9N3O3S |
| Net Charge | 0 |
| Average Mass | 299.311 |
| Monoisotopic Mass | 299.03646 |
| SMILES | O=C1NC(=S)NC(=O)C1=Cc1cc2ccccc2nc1=O |
| InChI | InChI=1S/C14H9N3O3S/c18-11-8(5-7-3-1-2-4-10(7)15-11)6-9-12(19)16-14(21)17-13(9)20/h1-6H,(H,15,18)(H2,16,17,19,20,21) |
| InChIKey | SEEZKTOCLICXGJ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-[(2-oxo-1H-quinolin-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione (CHEBI:119923) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31366 | LINCS |