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

Systemtic Name: 1-[4-(4-methylpiperazin-1-yl)cyclohexyl]-3-(4-phenylazanylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 3-(4-anilinophenyl)-1-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-(4-anilinophenyl)-1-[4-(4-methyl-1-piperazinyl)cyclohexyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 3-(4-anilinophenyl)-1-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [4-[4-amino-1-[4-(4-methylpiperazino)cyclohexyl]pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-phenyl-amine Formula: C28H34N8 MolecularWeight: 482.62316

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCC(CC2)N3C4=C(C(=N3)C5=CC=C(C=C5)NC6=CC=CC=C6)C(=NC=N4)N

Isomeric SMILES

CN1CCN(CC1)C2CCC(CC2)N3C4=C(C(=N3)C5=CC=C(C=C5)NC6=CC=CC=C6)C(=NC=N4)N

InChI

InChI=1S/C28H34N8/c1-34-15-17-35(18-16-34)23-11-13-24(14-12-23)36-28-25(27(29)30-19-31-28)26(33-36)20-7-9-22(10-8-20)32-21-5-3-2-4-6-21/h2-10,19,23-24,32H,11-18H2,1H3,(H2,29,30,31)