EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H13ClF3N3O2 |
| Net Charge | 0 |
| Average Mass | 359.735 |
| Monoisotopic Mass | 359.06484 |
| SMILES | Cc1c(N=CC(Cl)C(=O)C(F)(F)F)c(=O)n(-c2ccccc2)n1C |
| InChI | InChI=1S/C15H13ClF3N3O2/c1-9-12(20-8-11(16)13(23)15(17,18)19)14(24)22(21(9)2)10-6-4-3-5-7-10/h3-8,11H,1-2H3 |
| InChIKey | NOQGFDAJCNDPKM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-31340 (CHEBI:119896) is a pyrazoles (CHEBI:26410) |
| LSM-31340 (CHEBI:119896) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31340 | LINCS |