EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C17H16N4O3S |
| Net Charge | 0 |
| Average Mass | 356.407 |
| Monoisotopic Mass | 356.09431 |
| SMILES | COc1ccccc1NC(=O)CCSc1nnc(-c2ccncc2)o1 |
| InChI | InChI=1S/C17H16N4O3S/c1-23-14-5-3-2-4-13(14)19-15(22)8-11-25-17-21-20-16(24-17)12-6-9-18-10-7-12/h2-7,9-10H,8,11H2,1H3,(H,19,22) |
| InChIKey | RLBALFNHRPXFHR-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(2-methoxyphenyl)-3-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thio]propanamide (CHEBI:106007) is a anilide (CHEBI:13248) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17368 | LINCS |