4-(4-methylpiperazin-1-yl)-7-(2-methylpropyl)-2-(naphthalen-1-ylmethyl)-3-pyridin-4-yl-pyrazolo[3,4-d]pyrimidin-6-one

Systemtic Name: 4-(4-methylpiperazin-1-yl)-7-(2-methylpropyl)-2-(naphthalen-1-ylmethyl)-3-pyridin-4-yl-pyrazolo[3,4-d]pyrimidin-6-one Openeye Name: 7-isobutyl-4-(4-methylpiperazin-1-yl)-2-(1-naphthylmethyl)-3-(4-pyridyl)pyrazolo[3,4-d]pyrimidin-6-one CAS Name: 4-(4-methyl-1-piperazinyl)-7-(2-methylpropyl)-2-(1-naphthalenylmethyl)-3-pyridin-4-yl-6-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 4-(4-methylpiperazin-1-yl)-7-(2-methylpropyl)-2-(naphthalen-1-ylmethyl)-3-pyridin-4-ylpyrazolo[3,4-d]pyrimidin-6-one Traditional Name: 7-isobutyl-4-(4-methylpiperazino)-2-(1-naphthylmethyl)-3-(4-pyridyl)pyrazolo[3,4-d]pyrimidin-6-one Formula: C30H33N7O MolecularWeight: 507.62932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=NN(C(=C2C(=NC1=O)N3CCN(CC3)C)C4=CC=NC=C4)CC5=CC=CC6=CC=CC=C65

Isomeric SMILES

CC(C)CN1C2=NN(C(=C2C(=NC1=O)N3CCN(CC3)C)C4=CC=NC=C4)CC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C30H33N7O/c1-21(2)19-36-29-26(28(32-30(36)38)35-17-15-34(3)16-18-35)27(23-11-13-31-14-12-23)37(33-29)20-24-9-6-8-22-7-4-5-10-25(22)24/h4-14,21H,15-20H2,1-3H3