EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H26N2O4S |
| Net Charge | 0 |
| Average Mass | 390.505 |
| Monoisotopic Mass | 390.16133 |
| SMILES | COc1ccc(S(=O)(=O)N2CCN(c3c(C)cccc3C)CC2)cc1OC |
| InChI | InChI=1S/C20H26N2O4S/c1-15-6-5-7-16(2)20(15)21-10-12-22(13-11-21)27(23,24)17-8-9-18(25-3)19(14-17)26-4/h5-9,14H,10-13H2,1-4H3 |
| InChIKey | KLVSKFLMGKPHDM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(3,4-dimethoxyphenyl)sulfonyl-4-(2,6-dimethylphenyl)piperazine (CHEBI:120794) is a piperazines (CHEBI:26144) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32237 | LINCS |