EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H15N3O2S |
| Net Charge | 0 |
| Average Mass | 289.360 |
| Monoisotopic Mass | 289.08850 |
| SMILES | COc1cc(NC(=S)Nc2cccnc2)cc(OC)c1 |
| InChI | InChI=1S/C14H15N3O2S/c1-18-12-6-11(7-13(8-12)19-2)17-14(20)16-10-4-3-5-15-9-10/h3-9H,1-2H3,(H2,16,17,20) |
| InChIKey | JSTOLLBVRXQYDF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(3,5-dimethoxyphenyl)-3-(3-pyridinyl)thiourea (CHEBI:111180) is a thioureas (CHEBI:51276) |
| Manual Xrefs | Databases |
|---|---|
| LSM-22636 | LINCS |