1-adamantyl-[4-[3-methyl-1-phenyl-6-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-[3-methyl-1-phenyl-6-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: 1-adamantyl-[4-(6-benzyl-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: 1-adamantyl-[4-[3-methyl-1-phenyl-6-(phenylmethyl)-4-pyrazolo[3,4-d]pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: 1-adamantyl-[4-(6-benzyl-3-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: 1-adamantyl-[4-(6-benzyl-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methanone Formula: C34H38N6O MolecularWeight: 546.70512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=NC(=N2)CC3=CC=CC=C3)N4CCN(CC4)C(=O)C56CC7CC(C5)CC(C7)C6)C8=CC=CC=C8

Isomeric SMILES

CC1=NN(C2=C1C(=NC(=N2)CC3=CC=CC=C3)N4CCN(CC4)C(=O)C56CC7CC(C5)CC(C7)C6)C8=CC=CC=C8

InChI

InChI=1S/C34H38N6O/c1-23-30-31(38-12-14-39(15-13-38)33(41)34-20-25-16-26(21-34)18-27(17-25)22-34)35-29(19-24-8-4-2-5-9-24)36-32(30)40(37-23)28-10-6-3-7-11-28/h2-11,25-27H,12-22H2,1H3