1-[4-[6-(oxan-4-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-2-phenyl-butan-1-one

Systemtic Name: 1-[4-[6-(oxan-4-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-2-phenyl-butan-1-one Openeye Name: 2-phenyl-1-[4-(1-phenyl-6-tetrahydropyran-4-yl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]butan-1-one CAS Name: 1-[4-[6-(4-oxanyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl]-1-piperazinyl]-2-phenyl-1-butanone IUPAC Name: 1-[4-[6-(oxan-4-yl)-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]-2-phenylbutan-1-one Traditional Name: 2-phenyl-1-[4-(1-phenyl-6-tetrahydropyran-4-yl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]butan-1-one Formula: C30H34N6O2 MolecularWeight: 510.62996

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=NC(=NC4=C3C=NN4C5=CC=CC=C5)C6CCOCC6

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=NC(=NC4=C3C=NN4C5=CC=CC=C5)C6CCOCC6

InChI

InChI=1S/C30H34N6O2/c1-2-25(22-9-5-3-6-10-22)30(37)35-17-15-34(16-18-35)28-26-21-31-36(24-11-7-4-8-12-24)29(26)33-27(32-28)23-13-19-38-20-14-23/h3-12,21,23,25H,2,13-20H2,1H3