EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H17N3S |
| Net Charge | 0 |
| Average Mass | 271.389 |
| Monoisotopic Mass | 271.11432 |
| SMILES | C=CCc1c(C)nc(SC)nc1Nc1ccccc1 |
| InChI | InChI=1S/C15H17N3S/c1-4-8-13-11(2)16-15(19-3)18-14(13)17-12-9-6-5-7-10-12/h4-7,9-10H,1,8H2,2-3H3,(H,16,17,18) |
| InChIKey | ZIDHKBXHAVJWKD-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-methyl-2-(methylthio)-N-phenyl-5-prop-2-enyl-4-pyrimidinamine (CHEBI:109020) is a aryl sulfide (CHEBI:35683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20418 | LINCS |