EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H22N2OS |
| Net Charge | 0 |
| Average Mass | 326.465 |
| Monoisotopic Mass | 326.14528 |
| SMILES | Cc1ccc(OCCn2c(=S)nc3ccccc32)c(C(C)C)c1 |
| InChI | InChI=1S/C19H22N2OS/c1-13(2)15-12-14(3)8-9-18(15)22-11-10-21-17-7-5-4-6-16(17)20-19(21)23/h4-9,12-13H,10-11H2,1-3H3,(H,20,23) |
| InChIKey | ZDYAAMWLXNIXQT-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-[2-(4-methyl-2-propan-2-ylphenoxy)ethyl]-1H-benzimidazole-2-thione (CHEBI:107339) is a benzimidazoles (CHEBI:22715) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18693 | LINCS |