EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H18N8O4 |
| Net Charge | 0 |
| Average Mass | 446.427 |
| Monoisotopic Mass | 446.14510 |
| SMILES | CC(=NNC(=O)c1nnn(-c2nonc2N)c1-c1ccc2c(c1)OCO2)c1ccc(C)cc1 |
| InChI | InChI=1S/C21H18N8O4/c1-11-3-5-13(6-4-11)12(2)23-25-21(30)17-18(14-7-8-15-16(9-14)32-10-31-15)29(28-24-17)20-19(22)26-33-27-20/h3-9H,10H2,1-2H3,(H2,22,26)(H,25,30) |
| InChIKey | HFKWHFDKOWJDRR-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N-[1-(4-methylphenyl)ethylideneamino]-4-triazolecarboxamide (CHEBI:108408) is a triazoles (CHEBI:35727) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19784 | LINCS |