EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H13N3O2S |
| Net Charge | 0 |
| Average Mass | 287.344 |
| Monoisotopic Mass | 287.07285 |
| SMILES | CN1C(=O)C(=CN2CCc3ccccc32)C(=O)NC1=S |
| InChI | InChI=1S/C14H13N3O2S/c1-16-13(19)10(12(18)15-14(16)20)8-17-7-6-9-4-2-3-5-11(9)17/h2-5,8H,6-7H2,1H3,(H,15,18,20) |
| InChIKey | LNLLWFFXFPKOOV-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(2,3-dihydroindol-1-ylmethylidene)-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione (CHEBI:112762) is a indoles (CHEBI:24828) |
| Manual Xrefs | Databases |
|---|---|
| LSM-24172 | LINCS |