EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H17N3O2S |
| Net Charge | 0 |
| Average Mass | 327.409 |
| Monoisotopic Mass | 327.10415 |
| SMILES | CCc1cc2ccccc2nc1SCC(=O)Nc1cc(C)on1 |
| InChI | InChI=1S/C17H17N3O2S/c1-3-12-9-13-6-4-5-7-14(13)18-17(12)23-10-16(21)19-15-8-11(2)22-20-15/h4-9H,3,10H2,1-2H3,(H,19,20,21) |
| InChIKey | AJQDJWPKSULOFO-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[(3-ethyl-2-quinolinyl)thio]-N-(5-methyl-3-isoxazolyl)acetamide (CHEBI:121200) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32643 | LINCS |