EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H21FN8O3 |
| Net Charge | 0 |
| Average Mass | 464.461 |
| Monoisotopic Mass | 464.17206 |
| SMILES | CCCc1c(C(=O)NN=Cc2cccc(OCc3ccc(F)cc3)c2)nnn1-c1nonc1N |
| InChI | InChI=1S/C22H21FN8O3/c1-2-4-18-19(26-30-31(18)21-20(24)28-34-29-21)22(32)27-25-12-15-5-3-6-17(11-15)33-13-14-7-9-16(23)10-8-14/h3,5-12H,2,4,13H2,1H3,(H2,24,28)(H,27,32) |
| InChIKey | PEUDXRHCFBVMTL-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[[3-[(4-fluorophenyl)methoxy]phenyl]methylideneamino]-5-propyl-4-triazolecarboxamide (CHEBI:107446) is a aromatic ether (CHEBI:35618) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18801 | LINCS |