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CHEBI:125106 - cyclopentyl-[(1S,5R)-7-[4-(5-pyrimidinyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone

ChEBI IDCHEBI:125106
ChEBI Namecyclopentyl-[(1S,5R)-7-[4-(5-pyrimidinyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone
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FormulaC21H24N4O
Net Charge0
Average Mass348.450
Monoisotopic Mass348.19501
SMILESO=C(C1CCCC1)N1C[C@@H]2N[C@H](C1)C2c1ccc(-c2cncnc2)cc1
InChIInChI=1S/C21H24N4O/c26-21(16-3-1-2-4-16)25-11-18-20(19(12-25)24-18)15-7-5-14(6-8-15)17-9-22-13-23-10-17/h5-10,13,16,18-20,24H,1-4,11-12H2/t18-,19+,20?
InChIKeyJXWNPIBCTGNAKK-YOFSQIOKSA-N
ChEBI Ontology
Outgoing Relation(s)
cyclopentyl-[(1S,5R)-7-[4-(5-pyrimidinyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone (CHEBI:125106) is a pyrimidines (CHEBI:39447)
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LSM-36568LINCS