EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H20N2O |
| Net Charge | 0 |
| Average Mass | 268.360 |
| Monoisotopic Mass | 268.15756 |
| SMILES | CC(C)(C)c1cc(C(=O)NCc2ccccc2)ccn1 |
| InChI | InChI=1S/C17H20N2O/c1-17(2,3)15-11-14(9-10-18-15)16(20)19-12-13-7-5-4-6-8-13/h4-11H,12H2,1-3H3,(H,19,20) |
| InChIKey | VABBBUJUGHBTCN-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-tert-butyl-N-(phenylmethyl)-4-pyridinecarboxamide (CHEBI:112188) is a pyridinecarboxamide (CHEBI:25529) |
| Manual Xrefs | Databases |
|---|---|
| LSM-23600 | LINCS |