EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C12H11N3OS |
| Net Charge | 0 |
| Average Mass | 245.307 |
| Monoisotopic Mass | 245.06228 |
| SMILES | c1coc(CSCc2cn3cccnc3n2)c1 |
| InChI | InChI=1S/C12H11N3OS/c1-3-11(16-6-1)9-17-8-10-7-15-5-2-4-13-12(15)14-10/h1-7H,8-9H2 |
| InChIKey | IXSXGQYKFGAUOB-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[(2-furanylmethylthio)methyl]imidazo[1,2-a]pyrimidine (CHEBI:116852) is a imidazopyrimidine (CHEBI:35875) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28302 | LINCS |