EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H12F3N3S |
| Net Charge | 0 |
| Average Mass | 311.332 |
| Monoisotopic Mass | 311.07040 |
| SMILES | Cc1cccc(NC(=S)Nc2cccc(C(F)(F)F)c2)n1 |
| InChI | InChI=1S/C14H12F3N3S/c1-9-4-2-7-12(18-9)20-13(21)19-11-6-3-5-10(8-11)14(15,16)17/h2-8H,1H3,(H2,18,19,20,21) |
| InChIKey | YOLTWYWCCNWVTL-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(6-methyl-2-pyridinyl)-3-[3-(trifluoromethyl)phenyl]thiourea (CHEBI:121702) is a thioureas (CHEBI:51276) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33145 | LINCS |