6-[2-methyl-1-(4-methylpiperazin-1-yl)propyl]-5-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[2-methyl-1-(4-methylpiperazin-1-yl)propyl]-5-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-benzyl-6-[2-methyl-1-(4-methylpiperazin-1-yl)propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[2-methyl-1-(4-methyl-1-piperazinyl)propyl]-5-(phenylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 5-benzyl-6-[2-methyl-1-(4-methylpiperazin-1-yl)propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-benzyl-6-[2-methyl-1-(4-methylpiperazino)propyl]-1H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H28N6O MolecularWeight: 380.48662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NC2=C(C=NN2)C(=O)N1CC3=CC=CC=C3)N4CCN(CC4)C

Isomeric SMILES

CC(C)C(C1=NC2=C(C=NN2)C(=O)N1CC3=CC=CC=C3)N4CCN(CC4)C

InChI

InChI=1S/C21H28N6O/c1-15(2)18(26-11-9-25(3)10-12-26)20-23-19-17(13-22-24-19)21(28)27(20)14-16-7-5-4-6-8-16/h4-8,13,15,18H,9-12,14H2,1-3H3,(H,22,24)