EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H15N3O |
| Net Charge | 0 |
| Average Mass | 217.272 |
| Monoisotopic Mass | 217.12151 |
| SMILES | C=CCNc1oc(C2CCCC2)nc1C#N |
| InChI | InChI=1S/C12H15N3O/c1-2-7-14-12-10(8-13)15-11(16-12)9-5-3-4-6-9/h2,9,14H,1,3-7H2 |
| InChIKey | ZODKOHJNVBBFNH-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-cyclopentyl-5-(prop-2-enylamino)-4-oxazolecarbonitrile (CHEBI:93508) is a oxazole (CHEBI:35790) |
| Manual Xrefs | Databases |
|---|---|
| LSM-3931 | LINCS |