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

Systemtic Name: 2-ethyl-1-[4-[6-(oxan-4-yl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]hexan-1-one Openeye Name: 2-ethyl-1-[4-(1-phenyl-6-tetrahydropyran-4-yl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]hexan-1-one CAS Name: 2-ethyl-1-[4-[6-(4-oxanyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl]-1-piperazinyl]-1-hexanone IUPAC Name: 2-ethyl-1-[4-[6-(oxan-4-yl)-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl]hexan-1-one Traditional Name: 2-ethyl-1-[4-(1-phenyl-6-tetrahydropyran-4-yl-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]hexan-1-one Formula: C28H38N6O2 MolecularWeight: 490.64032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=CC=C4)C5CCOCC5

Isomeric SMILES

CCCCC(CC)C(=O)N1CCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=CC=C4)C5CCOCC5

InChI

InChI=1S/C28H38N6O2/c1-3-5-9-21(4-2)28(35)33-16-14-32(15-17-33)26-24-20-29-34(23-10-7-6-8-11-23)27(24)31-25(30-26)22-12-18-36-19-13-22/h6-8,10-11,20-22H,3-5,9,12-19H2,1-2H3