EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H21N7O3S |
| Net Charge | 0 |
| Average Mass | 427.490 |
| Monoisotopic Mass | 427.14266 |
| SMILES | NS(=O)(=O)c1ccc(Nc2ncc3cc4n(c3n2)C2(CCCCC2)C(=O)NN4)cc1 |
| InChI | InChI=1S/C19H21N7O3S/c20-30(28,29)14-6-4-13(5-7-14)22-18-21-11-12-10-15-24-25-17(27)19(8-2-1-3-9-19)26(15)16(12)23-18/h4-7,10-11,24H,1-3,8-9H2,(H,25,27)(H2,20,28,29)(H,21,22,23) |
| InChIKey | KGJVKYSVVOQPDL-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| inx-315 (CHEBI:759866) is a sulfonamide (CHEBI:35358) |
| Synonyms | Source |
|---|---|
| Inx-315 | ChEMBL |
| INX315 | ChEMBL |