EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H29N5O2S |
| Net Charge | 0 |
| Average Mass | 427.574 |
| Monoisotopic Mass | 427.20420 |
| SMILES | Cc1ccc(S(=O)(=O)NC2=NCN(C3CCN(Cc4ccccc4)CC3)CN2)cc1 |
| InChI | InChI=1S/C22H29N5O2S/c1-18-7-9-21(10-8-18)30(28,29)25-22-23-16-27(17-24-22)20-11-13-26(14-12-20)15-19-5-3-2-4-6-19/h2-10,20H,11-17H2,1H3,(H2,23,24,25) |
| InChIKey | VIDKBODSYYBQMG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-methyl-N-[3-[1-(phenylmethyl)-4-piperidinyl]-2,4-dihydro-1H-1,3,5-triazin-6-yl]benzenesulfonamide (CHEBI:108217) is a piperidines (CHEBI:26151) |
| Manual Xrefs | Databases |
|---|---|
| LSM-19594 | LINCS |