EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H10ClF3N4O2 |
| Net Charge | 0 |
| Average Mass | 346.696 |
| Monoisotopic Mass | 346.04444 |
| SMILES | Cn1cc(Cl)c(C(N)=NOC(=O)c2ccccc2C(F)(F)F)n1 |
| InChI | InChI=1S/C13H10ClF3N4O2/c1-21-6-9(14)10(19-21)11(18)20-23-12(22)7-4-2-3-5-8(7)13(15,16)17/h2-6H,1H3,(H2,18,20) |
| InChIKey | GNDYSBAGESYCAI-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(trifluoromethyl)benzoic acid [[amino-(4-chloro-1-methyl-3-pyrazolyl)methylidene]amino] ester (CHEBI:113171) is a (trifluoromethyl)benzenes (CHEBI:83565) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24582 | LINCS |