EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H16ClFN4OS |
| Net Charge | 0 |
| Average Mass | 438.915 |
| Monoisotopic Mass | 438.07174 |
| SMILES | O=C1C(=NNC(=S)Nc2ccccc2F)c2ccccc2N1Cc1cccc(Cl)c1 |
| InChI | InChI=1S/C22H16ClFN4OS/c23-15-7-5-6-14(12-15)13-28-19-11-4-1-8-16(19)20(21(28)29)26-27-22(30)25-18-10-3-2-9-17(18)24/h1-12H,13H2,(H2,25,27,30) |
| InChIKey | DKKJRZKCUUEAOO-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[[1-[(3-chlorophenyl)methyl]-2-oxo-3-indolylidene]amino]-3-(2-fluorophenyl)thiourea (CHEBI:120967) is a indoles (CHEBI:24828) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32410 | LINCS |