EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H17N5 |
| Net Charge | 0 |
| Average Mass | 279.347 |
| Monoisotopic Mass | 279.14840 |
| SMILES | CN1CCN(c2nc(C#N)cc(-c3ccccc3)n2)CC1 |
| InChI | InChI=1S/C16H17N5/c1-20-7-9-21(10-8-20)16-18-14(12-17)11-15(19-16)13-5-3-2-4-6-13/h2-6,11H,7-10H2,1H3 |
| InChIKey | WZSQNGJVDDWAMW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(4-methyl-1-piperazinyl)-6-phenyl-4-pyrimidinecarbonitrile (CHEBI:111262) is a pyrimidines (CHEBI:39447) |
| Manual Xrefs | Databases |
|---|---|
| LSM-22718 | LINCS |