1-[4-(4-methylpiperazin-1-yl)cyclohexyl]-3-(6-phenoxypyridin-3-yl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-[4-(4-methylpiperazin-1-yl)cyclohexyl]-3-(6-phenoxypyridin-3-yl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-[4-(4-methylpiperazin-1-yl)cyclohexyl]-3-(6-phenoxy-3-pyridyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-[4-(4-methyl-1-piperazinyl)cyclohexyl]-3-(6-phenoxy-3-pyridinyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-[4-(4-methylpiperazin-1-yl)cyclohexyl]-3-(6-phenoxypyridin-3-yl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-[4-(4-methylpiperazino)cyclohexyl]-3-(6-phenoxy-3-pyridyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C27H32N8O MolecularWeight: 484.59598

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCC(CC2)N3C4=C(C(=N3)C5=CN=C(C=C5)OC6=CC=CC=C6)C(=NC=N4)N

Isomeric SMILES

CN1CCN(CC1)C2CCC(CC2)N3C4=C(C(=N3)C5=CN=C(C=C5)OC6=CC=CC=C6)C(=NC=N4)N

InChI

InChI=1S/C27H32N8O/c1-33-13-15-34(16-14-33)20-8-10-21(11-9-20)35-27-24(26(28)30-18-31-27)25(32-35)19-7-12-23(29-17-19)36-22-5-3-2-4-6-22/h2-7,12,17-18,20-21H,8-11,13-16H2,1H3,(H2,28,30,31)