EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H19N3S |
| Net Charge | 0 |
| Average Mass | 297.427 |
| Monoisotopic Mass | 297.12997 |
| SMILES | CCC(=NNC(=S)Nc1cccc(C)c1)c1ccccc1 |
| InChI | InChI=1S/C17H19N3S/c1-3-16(14-9-5-4-6-10-14)19-20-17(21)18-15-11-7-8-13(2)12-15/h4-12H,3H2,1-2H3,(H2,18,20,21) |
| InChIKey | YXRSTZXRGIBZBD-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-(3-methylphenyl)-3-(1-phenylpropylideneamino)thiourea (CHEBI:117262) is a alkylbenzene (CHEBI:38976) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28711 | LINCS |