9-[(4-fluorophenyl)methyl]-8-[(1-methylpiperidin-4-yl)methyl]-3H-purin-6-one

Systemtic Name: 9-[(4-fluorophenyl)methyl]-8-[(1-methylpiperidin-4-yl)methyl]-3H-purin-6-one Openeye Name: 9-[(4-fluorophenyl)methyl]-8-[(1-methyl-4-piperidyl)methyl]-3H-purin-6-one CAS Name: 9-[(4-fluorophenyl)methyl]-8-[(1-methyl-4-piperidinyl)methyl]-3H-purin-6-one IUPAC Name: 9-[(4-fluorophenyl)methyl]-8-[(1-methylpiperidin-4-yl)methyl]-3H-purin-6-one Traditional Name: 9-(4-fluorobenzyl)-8-[(1-methyl-4-piperidyl)methyl]-3H-purin-6-one Formula: C19H22FN5O MolecularWeight: 355.409283

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)CC2=NC3=C(N2CC4=CC=C(C=C4)F)NC=NC3=O

Isomeric SMILES

CN1CCC(CC1)CC2=NC3=C(N2CC4=CC=C(C=C4)F)NC=NC3=O

InChI

InChI=1S/C19H22FN5O/c1-24-8-6-13(7-9-24)10-16-23-17-18(21-12-22-19(17)26)25(16)11-14-2-4-15(20)5-3-14/h2-5,12-13H,6-11H2,1H3,(H,21,22,26)