EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H16N2O2S |
| Net Charge | 0 |
| Average Mass | 312.394 |
| Monoisotopic Mass | 312.09325 |
| SMILES | COc1ccc(-c2cn(-c3ccc(OC)cc3)c(=S)n2)cc1 |
| InChI | InChI=1S/C17H16N2O2S/c1-20-14-7-3-12(4-8-14)16-11-19(17(22)18-16)13-5-9-15(21-2)10-6-13/h3-11H,1-2H3,(H,18,22) |
| InChIKey | ODKDXITYOHYPBY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3,5-bis(4-methoxyphenyl)-1H-imidazole-2-thione (CHEBI:112977) is a 1,3-dihydroimidazole-2-thiones (CHEBI:139340) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24387 | LINCS |