EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H22N4S |
| Net Charge | 0 |
| Average Mass | 338.480 |
| Monoisotopic Mass | 338.15652 |
| SMILES | Cc1csc2ncnc(NC3CCN(Cc4ccccc4)CC3)c12 |
| InChI | InChI=1S/C19H22N4S/c1-14-12-24-19-17(14)18(20-13-21-19)22-16-7-9-23(10-8-16)11-15-5-3-2-4-6-15/h2-6,12-13,16H,7-11H2,1H3,(H,20,21,22) |
| InChIKey | GYQNXYQGNUDXME-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-methyl-N-[1-(phenylmethyl)-4-piperidinyl]-4-thieno[2,3-d]pyrimidinamine (CHEBI:109165) is a piperidines (CHEBI:26151) |
| 5-methyl-N-[1-(phenylmethyl)-4-piperidinyl]-4-thieno[2,3-d]pyrimidinamine (CHEBI:109165) is a thienopyrimidine (CHEBI:143212) |
| Manual Xrefs | Databases |
|---|---|
| LSM-20562 | LINCS |