1-[4-[3-methyl-6-(oxan-4-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[4-[3-methyl-6-(oxan-4-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[4-(3-methyl-1-phenyl-6-tetrahydropyran-4-yl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-2-phenoxy-ethanone CAS Name: 1-[4-[3-methyl-6-(4-oxanyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl]-1-piperazinyl]-2-phenoxyethanone IUPAC Name: 1-[4-[3-methyl-6-(oxan-4-yl)-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-2-phenoxyethanone Traditional Name: 1-[4-(3-methyl-1-phenyl-6-tetrahydropyran-4-yl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]-2-phenoxy-ethanone Formula: C29H32N6O3 MolecularWeight: 512.60278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=NC(=N2)C3CCOCC3)N4CCN(CC4)C(=O)COC5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C2=C1C(=NC(=N2)C3CCOCC3)N4CCN(CC4)C(=O)COC5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C29H32N6O3/c1-21-26-28(34-16-14-33(15-17-34)25(36)20-38-24-10-6-3-7-11-24)30-27(22-12-18-37-19-13-22)31-29(26)35(32-21)23-8-4-2-5-9-23/h2-11,22H,12-20H2,1H3