EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H22N2O2S |
| Net Charge | 0 |
| Average Mass | 330.453 |
| Monoisotopic Mass | 330.14020 |
| SMILES | CCCCCCSC1=C(C#N)C(c2ccc(O)cc2)CC(=O)N1 |
| InChI | InChI=1S/C18H22N2O2S/c1-2-3-4-5-10-23-18-16(12-19)15(11-17(22)20-18)13-6-8-14(21)9-7-13/h6-9,15,21H,2-5,10-11H2,1H3,(H,20,22) |
| InChIKey | HYBLKCYMQMUZPK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-(hexylthio)-4-(4-hydroxyphenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile (CHEBI:122203) is a phenols (CHEBI:33853) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33646 | LINCS |