EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H18N4O4S |
| Net Charge | 0 |
| Average Mass | 410.455 |
| Monoisotopic Mass | 410.10488 |
| SMILES | COc1ccccc1NC(=O)CSc1nnc(-c2ccco2)n1Cc1ccco1 |
| InChI | InChI=1S/C20H18N4O4S/c1-26-16-8-3-2-7-15(16)21-18(25)13-29-20-23-22-19(17-9-5-11-28-17)24(20)12-14-6-4-10-27-14/h2-11H,12-13H2,1H3,(H,21,25) |
| InChIKey | FUCIAIPGZRXNGA-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[[5-(2-furanyl)-4-(2-furanylmethyl)-1,2,4-triazol-3-yl]thio]-N-(2-methoxyphenyl)acetamide (CHEBI:120721) is a anilide (CHEBI:13248) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32163 | LINCS |