EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H27N3O2S |
| Net Charge | 0 |
| Average Mass | 373.522 |
| Monoisotopic Mass | 373.18240 |
| SMILES | c1ccc(-c2cnc(SCCN3CCOCC3)n2CC2CCCO2)cc1 |
| InChI | InChI=1S/C20H27N3O2S/c1-2-5-17(6-3-1)19-15-21-20(23(19)16-18-7-4-11-25-18)26-14-10-22-8-12-24-13-9-22/h1-3,5-6,15,18H,4,7-14,16H2 |
| InChIKey | KVTXZXQSXDFEFG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[2-[[1-(2-oxolanylmethyl)-5-phenyl-2-imidazolyl]thio]ethyl]morpholine (CHEBI:104181) is a imidazoles (CHEBI:24780) |
| Manual Xrefs | Databases |
|---|---|
| LSM-15545 | LINCS |