EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H14BrN3O |
| Net Charge | 0 |
| Average Mass | 356.223 |
| Monoisotopic Mass | 355.03202 |
| SMILES | C[C@H](NC(=O)/C(C#N)=C/c1cccc(Br)n1)c1ccccc1 |
| InChI | InChI=1S/C17H14BrN3O/c1-12(13-6-3-2-4-7-13)20-17(22)14(11-19)10-15-8-5-9-16(18)21-15/h2-10,12H,1H3,(H,20,22)/b14-10+/t12-/m0/s1 |
| InChIKey | VFUAJMPDXIRPKO-LQELWAHVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| wp 1066 (CHEBI:750292) is a chloropyridine (CHEBI:39173) |
| Synonyms | Source |
|---|---|
| Wp1066 | ChEMBL |
| WP-1066 | ChEMBL |
| Citations |
|---|