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CHEBI:39650 - 3-{[2-(1H-benzimidazol-1-yl)-6-{[2-(diethylamino)ethyl]amino}pyrimidin-4-yl]amino}-4-methylphenol

ChEBI IDCHEBI:39650
ChEBI Name3-{[2-(1H-benzimidazol-1-yl)-6-{[2-(diethylamino)ethyl]amino}pyrimidin-4-yl]amino}-4-methylphenol
Stars
ASCII Name3-{[2-(1H-benzimidazol-1-yl)-6-{[2-(diethylamino)ethyl]amino}pyrimidin-4-yl]amino}-4-methylphenol
Last Modified17 October 2009
DownloadsMolfile
FormulaC24H29N7O
Net Charge0
Average Mass431.544
Monoisotopic Mass431.24336
SMILES[H]Oc1c([H])c([H])c(C([H])([H])[H])c(N([H])c2nc(-n3c([H])nc4c([H])c([H])c([H])c([H])c43)nc(N([H])C([H])([H])C([H])([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])c2[H])c1[H]
InChIInChI=1S/C24H29N7O/c1-4-30(5-2)13-12-25-22-15-23(27-20-14-18(32)11-10-17(20)3)29-24(28-22)31-16-26-19-8-6-7-9-21(19)31/h6-11,14-16,32H,4-5,12-13H2,1-3H3,(H2,25,27,28,29)
InChIKeyOAILDJYOGMMAOQ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-{[2-(1H-benzimidazol-1-yl)-6-{[2-(diethylamino)ethyl]amino}pyrimidin-4-yl]amino}-4-methylphenol (CHEBI:39650) is a aminopyrimidine (CHEBI:38338)
3-{[2-(1H-benzimidazol-1-yl)-6-{[2-(diethylamino)ethyl]amino}pyrimidin-4-yl]amino}-4-methylphenol (CHEBI:39650) is a benzimidazoles (CHEBI:22715)
3-{[2-(1H-benzimidazol-1-yl)-6-{[2-(diethylamino)ethyl]amino}pyrimidin-4-yl]amino}-4-methylphenol (CHEBI:39650) is a phenols (CHEBI:33853)
Synonyms  Source
3-{[2-(1H-BENZIMIDAZOL-1-YL)-6-{[2-(DIETHYLAMINO)ETHYL]AMINO}PYRIMIDIN-4-YL]AMINO}-4-METHYLPHENOLPDBeChem
3-{[2-(1H-benzimidazol-1-yl)-6-{[2-(diethylamino)ethyl]amino}pyrimidin-4-yl]amino}-4-methylphenolPDBeChem
Manual XrefsDatabases
1BMPDBeChem