EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H20N2O2S |
| Net Charge | 0 |
| Average Mass | 376.481 |
| Monoisotopic Mass | 376.12455 |
| SMILES | CCCC1=Nc2cc(C(=O)NCc3ccco3)ccc2Sc2ccccc21 |
| InChI | InChI=1S/C22H20N2O2S/c1-2-6-18-17-8-3-4-9-20(17)27-21-11-10-15(13-19(21)24-18)22(25)23-14-16-7-5-12-26-16/h3-5,7-13H,2,6,14H2,1H3,(H,23,25) |
| InChIKey | CASKODLSBWDLAY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(2-furanylmethyl)-6-propyl-3-benzo[b][1,4]benzothiazepinecarboxamide (CHEBI:107344) is a dibenzothiazepine (CHEBI:39268) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18698 | LINCS |