EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H16ClN3S |
| Net Charge | 0 |
| Average Mass | 317.845 |
| Monoisotopic Mass | 317.07535 |
| SMILES | S=C(NCCc1ccccc1)NN=Cc1ccccc1Cl |
| InChI | InChI=1S/C16H16ClN3S/c17-15-9-5-4-8-14(15)12-19-20-16(21)18-11-10-13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H2,18,20,21) |
| InChIKey | QUKYFVRLDWWACA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[(2-chlorophenyl)methylideneamino]-3-(2-phenylethyl)thiourea (CHEBI:121093) is a organochlorine compound (CHEBI:36683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32536 | LINCS |