EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H17N3O4S |
| Net Charge | 0 |
| Average Mass | 359.407 |
| Monoisotopic Mass | 359.09398 |
| SMILES | Cc1cc(=O)oc2cc(OCC(=O)Nc3nnc(C(C)C)s3)ccc12 |
| InChI | InChI=1S/C17H17N3O4S/c1-9(2)16-19-20-17(25-16)18-14(21)8-23-11-4-5-12-10(3)6-15(22)24-13(12)7-11/h4-7,9H,8H2,1-3H3,(H,18,20,21) |
| InChIKey | SLYGXKIQTSSLCA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)acetamide (CHEBI:121915) is a coumarins (CHEBI:23403) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33358 | LINCS |