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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N2CCN(CC2)C3=NC(=NC4=C3C=NN4C5=CC=CC=C5)C6CCOCC6

Isomeric SMILES

C1CCC(C1)CCC(=O)N2CCN(CC2)C3=NC(=NC4=C3C=NN4C5=CC=CC=C5)C6CCOCC6

InChI

InChI=1S/C28H36N6O2/c35-25(11-10-21-6-4-5-7-21)32-14-16-33(17-15-32)27-24-20-29-34(23-8-2-1-3-9-23)28(24)31-26(30-27)22-12-18-36-19-13-22/h1-3,8-9,20-22H,4-7,10-19H2