EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H19N3O4S |
| Net Charge | 0 |
| Average Mass | 409.467 |
| Monoisotopic Mass | 409.10963 |
| SMILES | COc1ccc(-c2ccc(C#N)c(SCC(=O)NCc3ccco3)n2)cc1OC |
| InChI | InChI=1S/C21H19N3O4S/c1-26-18-8-6-14(10-19(18)27-2)17-7-5-15(11-22)21(24-17)29-13-20(25)23-12-16-4-3-9-28-16/h3-10H,12-13H2,1-2H3,(H,23,25) |
| InChIKey | RJPBPYIQAXBWNN-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[3-cyano-6-(3,4-dimethoxyphenyl)-2-pyridinyl]thio]-N-(2-furanylmethyl)acetamide (CHEBI:108488) is a phenylpyridine (CHEBI:38193) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19864 | LINCS |