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

Systemtic Name: cyclohexyl-[4-[3-methyl-1-phenyl-6-(phenylmethyl)pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: [4-(6-benzyl-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-cyclohexyl-methanone CAS Name: cyclohexyl-[4-[3-methyl-1-phenyl-6-(phenylmethyl)-4-pyrazolo[3,4-d]pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: [4-(6-benzyl-3-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-cyclohexylmethanone Traditional Name: [4-(6-benzyl-3-methyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]-cyclohexyl-methanone Formula: C30H34N6O MolecularWeight: 494.63056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=NC(=N2)CC3=CC=CC=C3)N4CCN(CC4)C(=O)C5CCCCC5)C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C2=C1C(=NC(=N2)CC3=CC=CC=C3)N4CCN(CC4)C(=O)C5CCCCC5)C6=CC=CC=C6

InChI

InChI=1S/C30H34N6O/c1-22-27-28(34-17-19-35(20-18-34)30(37)24-13-7-3-8-14-24)31-26(21-23-11-5-2-6-12-23)32-29(27)36(33-22)25-15-9-4-10-16-25/h2,4-6,9-12,15-16,24H,3,7-8,13-14,17-21H2,1H3