EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H17N3O2S2 |
| Net Charge | 0 |
| Average Mass | 347.465 |
| Monoisotopic Mass | 347.07622 |
| SMILES | CSc1ccccc1C(=O)C1CCCN(C(=O)c2csnn2)C1 |
| InChI | InChI=1S/C16H17N3O2S2/c1-22-14-7-3-2-6-12(14)15(20)11-5-4-8-19(9-11)16(21)13-10-23-18-17-13/h2-3,6-7,10-11H,4-5,8-9H2,1H3 |
| InChIKey | AKURUKNQDJYGJR-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [2-(methylthio)phenyl]-[1-[oxo(4-thiadiazolyl)methyl]-3-piperidinyl]methanone (CHEBI:106008) is a aromatic ketone (CHEBI:76224) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17369 | LINCS |