EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H14ClN3O3 |
| Net Charge | 0 |
| Average Mass | 379.803 |
| Monoisotopic Mass | 379.07237 |
| SMILES | O=C(COc1ccc(Cl)cc1)Nc1ccc2oc(-c3ccncc3)nc2c1 |
| InChI | InChI=1S/C20H14ClN3O3/c21-14-1-4-16(5-2-14)26-12-19(25)23-15-3-6-18-17(11-15)24-20(27-18)13-7-9-22-10-8-13/h1-11H,12H2,(H,23,25) |
| InChIKey | ZFVQEFNMMHFWNK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(4-chlorophenoxy)-N-(2-pyridin-4-yl-1,3-benzoxazol-5-yl)acetamide (CHEBI:107374) is a benzoxazole (CHEBI:46700) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18728 | LINCS |