EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C16H21N3OS |
| Net Charge | 0 |
| Average Mass | 303.431 |
| Monoisotopic Mass | 303.14053 |
| SMILES | CCSc1nc2ccccc2n1CC(=O)N1CCCCC1 |
| InChI | InChI=1S/C16H21N3OS/c1-2-21-16-17-13-8-4-5-9-14(13)19(16)12-15(20)18-10-6-3-7-11-18/h4-5,8-9H,2-3,6-7,10-12H2,1H3 |
| InChIKey | CVCVTBPAWRMOHF-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[2-(ethylthio)-1-benzimidazolyl]-1-(1-piperidinyl)ethanone (CHEBI:109246) is a benzimidazoles (CHEBI:22715) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20643 | LINCS |