EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H15N3O2 |
| Net Charge | 0 |
| Average Mass | 281.315 |
| Monoisotopic Mass | 281.11643 |
| SMILES | CCCC(=O)Nc1ccc2oc(-c3cccnc3)nc2c1 |
| InChI | InChI=1S/C16H15N3O2/c1-2-4-15(20)18-12-6-7-14-13(9-12)19-16(21-14)11-5-3-8-17-10-11/h3,5-10H,2,4H2,1H3,(H,18,20) |
| InChIKey | LOIKNWPFNIRTAC-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[2-(3-pyridinyl)-1,3-benzoxazol-5-yl]butanamide (CHEBI:122059) is a benzoxazole (CHEBI:46700) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33502 | LINCS |