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CHEBI:49539 - 1-{7-cyclohexyl-6-[4-(4-methylpiperazin-1-yl)benzyl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl}methanamine

Default Structure
ChEBI IDCHEBI:49539
ChEBI Name1-{7-cyclohexyl-6-[4-(4-methylpiperazin-1-yl)benzyl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl}methanamine
Stars
DownloadsMolfile
FormulaC25H34N6
Net Charge0
Average Mass418.589
Monoisotopic Mass418.28450
SMILES[H]c1c([H])c(C([H])([H])c2c([H])c3c([H])nc(C([H])([H])N([H])[H])nc3n2C2([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C2([H])[H])c([H])c([H])c1N1C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])C1([H])[H]
InChIInChI=1S/C25H34N6/c1-29-11-13-30(14-12-29)21-9-7-19(8-10-21)15-23-16-20-18-27-24(17-26)28-25(20)31(23)22-5-3-2-4-6-22/h7-10,16,18,22H,2-6,11-15,17,26H2,1H3
InChIKeyGCJSOJRPNOWSEH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-{7-cyclohexyl-6-[4-(4-methylpiperazin-1-yl)benzyl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl}methanamine (CHEBI:49539) is a unclassifieds (CHEBI:27189)
Synonym  Source
1-{7-cyclohexyl-6-[4-(4-methylpiperazin-1-yl)benzyl]-7H-pyrrolo[2,3-d]pyrimidin-2-yl}methanaminePDBeChem
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