EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H19N3S |
| Net Charge | 0 |
| Average Mass | 261.394 |
| Monoisotopic Mass | 261.12997 |
| SMILES | CC1CCC2(CC1)NC(=S)N(c1ccccc1)N2 |
| InChI | InChI=1S/C14H19N3S/c1-11-7-9-14(10-8-11)15-13(18)17(16-14)12-5-3-2-4-6-12/h2-6,11,16H,7-10H2,1H3,(H,15,18) |
| InChIKey | DVZJMOAGWCDCSM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 8-methyl-2-phenyl-1,2,4-triazaspiro[4.5]decane-3-thione (CHEBI:120758) is a benzenes (CHEBI:22712) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32200 | LINCS |