EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H17N3O4S3 |
| Net Charge | 0 |
| Average Mass | 447.563 |
| Monoisotopic Mass | 447.03812 |
| SMILES | Cc1nc2c(cc(Oc3ccc(S(=O)(=O)N4CCOCC4)cn3)c3ccsc32)s1 |
| InChI | InChI=1S/C19H17N3O4S3/c1-12-21-18-16(28-12)10-15(14-4-9-27-19(14)18)26-17-3-2-13(11-20-17)29(23,24)22-5-7-25-8-6-22/h2-4,9-11H,5-8H2,1H3 |
| InChIKey | MPSXPWMJSXBEON-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[[6-[(2-methyl-5-thieno[2,3-e][1,3]benzothiazolyl)oxy]-3-pyridinyl]sulfonyl]morpholine (CHEBI:107912) is a aromatic ether (CHEBI:35618) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19289 | LINCS |