EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H26N6O2S2 |
| Net Charge | 0 |
| Average Mass | 494.646 |
| Monoisotopic Mass | 494.15587 |
| SMILES | [H]N(C(=O)c1cccc(CSc2nnc(Cc3csc(N)n3)n2CC)c1)c1cccc(OCC)c1 |
| InChI | InChI=1S/C24H26N6O2S2/c1-3-30-21(13-19-15-33-23(25)27-19)28-29-24(30)34-14-16-7-5-8-17(11-16)22(31)26-18-9-6-10-20(12-18)32-4-2/h5-12,15H,3-4,13-14H2,1-2H3,(H2,25,27)(H,26,31) |
| InChIKey | GYLMMDNXCAFUKV-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 9k (CHEBI:194234) is a organic molecular entity (CHEBI:50860) |