EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H20N2S |
| Net Charge | 0 |
| Average Mass | 296.439 |
| Monoisotopic Mass | 296.13472 |
| SMILES | Cc1nc2c(c(=S)n1)C1(CCCCC1)Cc1ccccc1-2 |
| InChI | InChI=1S/C18H20N2S/c1-12-19-16-14-8-4-3-7-13(14)11-18(9-5-2-6-10-18)15(16)17(21)20-12/h3-4,7-8H,2,5-6,9-11H2,1H3,(H,19,20,21) |
| InChIKey | GFVQCHYKKITWKQ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-methyl-4-spiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclohexane]thione (CHEBI:114455) is a quinazolines (CHEBI:38530) |
| Manual Xrefs | Databases |
|---|---|
| LSM-25916 | LINCS |