EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H25N3O3S |
| Net Charge | 0 |
| Average Mass | 363.483 |
| Monoisotopic Mass | 363.16166 |
| SMILES | CCCc1cc(=O)nc(SCC(=O)c2cc(C)n(CCOC)c2C)n1 |
| InChI | InChI=1S/C18H25N3O3S/c1-5-6-14-10-17(23)20-18(19-14)25-11-16(22)15-9-12(2)21(13(15)3)7-8-24-4/h9-10H,5-8,11H2,1-4H3,(H,19,20,23) |
| InChIKey | YWVUMGSIQSWJPZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[2-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl]thio]-6-propyl-1H-pyrimidin-4-one (CHEBI:109856) is a aryl sulfide (CHEBI:35683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-21284 | LINCS |