EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H24N6O2S |
| Net Charge | 0 |
| Average Mass | 400.508 |
| Monoisotopic Mass | 400.16815 |
| SMILES | Cc1cc(NC(=O)CSc2nnc(C(C)N(C)C)n2Cc2ccccc2)no1 |
| InChI | InChI=1S/C19H24N6O2S/c1-13-10-16(23-27-13)20-17(26)12-28-19-22-21-18(14(2)24(3)4)25(19)11-15-8-6-5-7-9-15/h5-10,14H,11-12H2,1-4H3,(H,20,23,26) |
| InChIKey | IOWSCODSLOWXSF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[5-[1-(dimethylamino)ethyl]-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-(5-methyl-3-isoxazolyl)acetamide (CHEBI:112872) is a aromatic amide (CHEBI:62733) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24282 | LINCS |