EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H25N3O4S |
| Net Charge | 0 |
| Average Mass | 391.493 |
| Monoisotopic Mass | 391.15658 |
| SMILES | CCOc1cc2nc(=S)n(CCCN3CCCC3=O)c(=O)c2cc1OCC |
| InChI | InChI=1S/C19H25N3O4S/c1-3-25-15-11-13-14(12-16(15)26-4-2)20-19(27)22(18(13)24)10-6-9-21-8-5-7-17(21)23/h11-12H,3-10H2,1-2H3,(H,20,27) |
| InChIKey | DMRBOZKOYDEYEY-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6,7-diethoxy-3-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-sulfanylidene-1H-quinazolin-4-one (CHEBI:105687) is a quinazolines (CHEBI:38530) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17049 | LINCS |