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

Systemtic Name: cyclohexyl-[4-[3-methyl-6-(oxan-4-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: cyclohexyl-[4-(3-methyl-1-phenyl-6-tetrahydropyran-4-yl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: cyclohexyl-[4-[3-methyl-6-(4-oxanyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: cyclohexyl-[4-[3-methyl-6-(oxan-4-yl)-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: cyclohexyl-[4-(3-methyl-1-phenyl-6-tetrahydropyran-4-yl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methanone Formula: C28H36N6O2 MolecularWeight: 488.62444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=NC(=N2)C3CCOCC3)N4CCN(CC4)C(=O)C5CCCCC5)C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C2=C1C(=NC(=N2)C3CCOCC3)N4CCN(CC4)C(=O)C5CCCCC5)C6=CC=CC=C6

InChI

InChI=1S/C28H36N6O2/c1-20-24-26(32-14-16-33(17-15-32)28(35)22-8-4-2-5-9-22)29-25(21-12-18-36-19-13-21)30-27(24)34(31-20)23-10-6-3-7-11-23/h3,6-7,10-11,21-22H,2,4-5,8-9,12-19H2,1H3