6-azanyl-2-butoxy-9-[3-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]propyl]-7H-purin-8-one

Systemtic Name: 6-azanyl-2-butoxy-9-[3-[4-(4-fluorophenyl)carbonylpiperidin-1-yl]propyl]-7H-purin-8-one Openeye Name: 6-amino-2-butoxy-9-[3-[4-(4-fluorobenzoyl)-1-piperidyl]propyl]-7H-purin-8-one CAS Name: 6-amino-2-butoxy-9-[3-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]propyl]-7H-purin-8-one IUPAC Name: 6-amino-2-butoxy-9-[3-[4-(4-fluorobenzoyl)piperidin-1-yl]propyl]-7H-purin-8-one Traditional Name: 6-amino-2-butoxy-9-[3-[4-(4-fluorobenzoyl)piperidino]propyl]-7H-purin-8-one Formula: C24H31FN6O3 MolecularWeight: 470.539743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCCN3CCC(CC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCCCOC1=NC2=C(C(=N1)N)NC(=O)N2CCCN3CCC(CC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H31FN6O3/c1-2-3-15-34-23-28-21(26)19-22(29-23)31(24(33)27-19)12-4-11-30-13-9-17(10-14-30)20(32)16-5-7-18(25)8-6-16/h5-8,17H,2-4,9-15H2,1H3,(H,27,33)(H2,26,28,29)