8-[(4-fluorophenyl)methyl]-2-(4-methylpiperazin-1-yl)-6-phenethyl-pteridin-7-one

Systemtic Name: 8-[(4-fluorophenyl)methyl]-2-(4-methylpiperazin-1-yl)-6-phenethyl-pteridin-7-one Openeye Name: 8-[(4-fluorophenyl)methyl]-2-(4-methylpiperazin-1-yl)-6-phenethyl-pteridin-7-one CAS Name: 8-[(4-fluorophenyl)methyl]-2-(4-methyl-1-piperazinyl)-6-phenethyl-7-pteridinone IUPAC Name: 8-[(4-fluorophenyl)methyl]-2-(4-methylpiperazin-1-yl)-6-phenethylpteridin-7-one Traditional Name: 8-(4-fluorobenzyl)-2-(4-methylpiperazino)-6-phenethyl-pteridin-7-one Formula: C26H27FN6O MolecularWeight: 458.530583

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C3C(=N2)N(C(=O)C(=N3)CCC4=CC=CC=C4)CC5=CC=C(C=C5)F

Isomeric SMILES

CN1CCN(CC1)C2=NC=C3C(=N2)N(C(=O)C(=N3)CCC4=CC=CC=C4)CC5=CC=C(C=C5)F

InChI

InChI=1S/C26H27FN6O/c1-31-13-15-32(16-14-31)26-28-17-23-24(30-26)33(18-20-7-10-21(27)11-8-20)25(34)22(29-23)12-9-19-5-3-2-4-6-19/h2-8,10-11,17H,9,12-16,18H2,1H3