EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H16N6O2S |
| Net Charge | 0 |
| Average Mass | 356.411 |
| Monoisotopic Mass | 356.10554 |
| SMILES | O=C(CSc1ccc2nnc(-c3cccnc3)n2n1)N1CCOCC1 |
| InChI | InChI=1S/C16H16N6O2S/c23-15(21-6-8-24-9-7-21)11-25-14-4-3-13-18-19-16(22(13)20-14)12-2-1-5-17-10-12/h1-5,10H,6-9,11H2 |
| InChIKey | GWCQIHVMZSGCGM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(4-morpholinyl)-2-[[3-(3-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio]ethanone (CHEBI:117170) is a triazoles (CHEBI:35727) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28619 | LINCS |