EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H35N5O |
| Net Charge | 0 |
| Average Mass | 445.611 |
| Monoisotopic Mass | 445.28416 |
| SMILES | [H]c1c([H])c([H])c(C([H])([H])C([H])([H])N([H])c2nc(N([H])[H])nc(C([H])([H])C([H])([H])[H])c2-c2c([H])c([H])c3c(c2[H])N(C([H])([H])C([H])([H])C([H])([H])OC([H])([H])[H])C([H])([H])C([H])([H])C3([H])[H])c([H])c1[H] |
| InChI | InChI=1S/C27H35N5O/c1-3-23-25(26(31-27(28)30-23)29-15-14-20-9-5-4-6-10-20)22-13-12-21-11-7-16-32(24(21)19-22)17-8-18-33-2/h4-6,9-10,12-13,19H,3,7-8,11,14-18H2,1-2H3,(H3,28,29,30,31) |
| InChIKey | DGNIHJBLLNEWQZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-ethyl-5-[1-(3-methoxypropyl)-1,2,3,4-tetrahydroquinolin-7-yl]-N4-(2-phenylethyl)pyrimidine-2,4-diamine (CHEBI:40194) is a aminopyrimidine (CHEBI:38338) |
| 6-ethyl-5-[1-(3-methoxypropyl)-1,2,3,4-tetrahydroquinolin-7-yl]-N4-(2-phenylethyl)pyrimidine-2,4-diamine (CHEBI:40194) is a quinolines (CHEBI:26513) |
| Synonyms | Source |
|---|---|
| 6-ETHYL-5-[1-(3-METHOXYPROPYL)-1,2,3,4-TETRAHYDROQUINOLIN-7-YL]-N~4~-(2-PHENYLETHYL)PYRIMIDINE-2,4-DIAMINE | PDBeChem |
| 6-ethyl-5-[1-(3-methoxypropyl)-1,2,3,4-tetrahydroquinolin-7-yl]-N~4~-(2-phenylethyl)pyrimidine-2,4-diamine | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| 6IG | PDBeChem |