EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H23FN4O3S |
| Net Charge | 0 |
| Average Mass | 442.516 |
| Monoisotopic Mass | 442.14749 |
| SMILES | CC(=O)N1CCC2(CC1)CC(=NNC(=S)Nc1ccccc1F)c1cc(O)ccc1O2 |
| InChI | InChI=1S/C22H23FN4O3S/c1-14(28)27-10-8-22(9-11-27)13-19(16-12-15(29)6-7-20(16)30-22)25-26-21(31)24-18-5-3-2-4-17(18)23/h2-7,12,29H,8-11,13H2,1H3,(H2,24,26,31) |
| InChIKey | LVDPHUNEBVLPFQ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[(1'-acetyl-6-hydroxy-4-spiro[3,4-dihydro-2H-1-benzopyran-2,4'-piperidine]ylidene)amino]-3-(2-fluorophenyl)thiourea (CHEBI:117212) is a 1-benzopyran (CHEBI:38443) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28661 | LINCS |