EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H17ClN4O2 |
| Net Charge | 0 |
| Average Mass | 344.802 |
| Monoisotopic Mass | 344.10400 |
| SMILES | CCc1nn(CC(=O)NCc2ccccc2Cl)c(=O)c2cccn12 |
| InChI | InChI=1S/C17H17ClN4O2/c1-2-15-20-22(17(24)14-8-5-9-21(14)15)11-16(23)19-10-12-6-3-4-7-13(12)18/h3-9H,2,10-11H2,1H3,(H,19,23) |
| InChIKey | NNMCTWVXYHSUPA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2-chlorophenyl)methyl]-2-(4-ethyl-1-oxo-2-pyrrolo[1,2-d][1,2,4]triazinyl)acetamide (CHEBI:114921) is a organochlorine compound (CHEBI:36683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-26384 | LINCS |