EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H17N5O2S2 |
| Net Charge | 0 |
| Average Mass | 399.501 |
| Monoisotopic Mass | 399.08237 |
| SMILES | CCOc1ccc2nc(NC(=O)CSc3nc4cccnc4n3C)sc2c1 |
| InChI | InChI=1S/C18H17N5O2S2/c1-3-25-11-6-7-12-14(9-11)27-17(20-12)22-15(24)10-26-18-21-13-5-4-8-19-16(13)23(18)2/h4-9H,3,10H2,1-2H3,(H,20,22,24) |
| InChIKey | CXSSCPPYFDIMTE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(6-ethoxy-1,3-benzothiazol-2-yl)-2-[(3-methyl-2-imidazo[4,5-b]pyridinyl)thio]acetamide (CHEBI:116715) is a imidazopyridine (CHEBI:46908) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28168 | LINCS |