EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C15H16FN3S |
| Net Charge | 0 |
| Average Mass | 289.379 |
| Monoisotopic Mass | 289.10490 |
| SMILES | CNC(=S)N1CCn2cccc2C1c1ccc(F)cc1 |
| InChI | InChI=1S/C15H16FN3S/c1-17-15(20)19-10-9-18-8-2-3-13(18)14(19)11-4-6-12(16)7-5-11/h2-8,14H,9-10H2,1H3,(H,17,20) |
| InChIKey | SRMOWRGHSFUUDT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(4-fluorophenyl)-N-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazine-2-carbothioamide (CHEBI:112345) is a organofluorine compound (CHEBI:37143) |
| Manual Xrefs | Databases |
|---|---|
| LSM-23757 | LINCS |