EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H22N4O2 |
| Net Charge | 0 |
| Average Mass | 374.444 |
| Monoisotopic Mass | 374.17428 |
| SMILES | [H]c1nc(C(=O)N([H])C([H])([H])c2c([H])c([H])c([H])c(C([H])([H])[H])c2[H])c([H])c(C(=O)N([H])C([H])([H])c2c([H])c([H])c([H])c(C([H])([H])[H])c2[H])n1 |
| InChI | InChI=1S/C22H22N4O2/c1-15-5-3-7-17(9-15)12-23-21(27)19-11-20(26-14-25-19)22(28)24-13-18-8-4-6-16(2)10-18/h3-11,14H,12-13H2,1-2H3,(H,23,27)(H,24,28) |
| InChIKey | GTBUZLPQANSGGE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N,N'-bis(3-methylbenzyl)pyrimidine-4,6-dicarboxamide (CHEBI:44912) is a pyrimidinecarboxamide (CHEBI:48438) |
| Synonyms | Source |
|---|---|
| N,N'-BIS(3-METHYLBENZYL)PYRIMIDINE-4,6-DICARBOXAMIDE | PDBeChem |
| N,N'-bis(3-methylbenzyl)pyrimidine-4,6-dicarboxamide | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| PB3 | PDBeChem |