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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(C=NN2)C(=O)N1CCC3=CC=CC=C3)N4CCN(CC4)C

Isomeric SMILES

CCC(C1=NC2=C(C=NN2)C(=O)N1CCC3=CC=CC=C3)N4CCN(CC4)C

InChI

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