EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H18N4O2 |
| Net Charge | 0 |
| Average Mass | 310.357 |
| Monoisotopic Mass | 310.14298 |
| SMILES | CCCC(=O)Nc1ccc2nn(-c3ccc(OC)cc3)nc2c1 |
| InChI | InChI=1S/C17H18N4O2/c1-3-4-17(22)18-12-5-10-15-16(11-12)20-21(19-15)13-6-8-14(23-2)9-7-13/h5-11H,3-4H2,1-2H3,(H,18,22) |
| InChIKey | NSJWOTURAYVXJE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[2-(4-methoxyphenyl)-5-benzotriazolyl]butanamide (CHEBI:107441) is a triazoles (CHEBI:35727) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18796 | LINCS |