EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H21N3O3S2 |
| Net Charge | 0 |
| Average Mass | 403.529 |
| Monoisotopic Mass | 403.10243 |
| SMILES | CNC(=S)N(Cc1cccs1)Cc1cc2cc(OC)c(OC)cc2nc1=O |
| InChI | InChI=1S/C19H21N3O3S2/c1-20-19(26)22(11-14-5-4-6-27-14)10-13-7-12-8-16(24-2)17(25-3)9-15(12)21-18(13)23/h4-9H,10-11H2,1-3H3,(H,20,26)(H,21,23) |
| InChIKey | SJRLELBWVYHFNK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-methyl-1-(thiophen-2-ylmethyl)thiourea (CHEBI:105826) is a quinolines (CHEBI:26513) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17187 | LINCS |