EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H26N4O5S2 |
| Net Charge | 0 |
| Average Mass | 490.607 |
| Monoisotopic Mass | 490.13446 |
| SMILES | COc1ccc(CCNC(=O)C2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)cc1OC |
| InChI | InChI=1S/C22H26N4O5S2/c1-30-18-7-6-15(14-19(18)31-2)8-11-23-22(27)16-9-12-26(13-10-16)33(28,29)20-5-3-4-17-21(20)25-32-24-17/h3-7,14,16H,8-13H2,1-2H3,(H,23,27) |
| InChIKey | RILWIHZZVLHXNW-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-4-piperidinecarboxamide (CHEBI:112721) is a dimethoxybenzene (CHEBI:51681) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24131 | LINCS |