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

Systemtic Name: 3-(4-methylphenyl)-1-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-[4-(4-methylpiperazin-1-yl)cyclohexyl]-3-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-(4-methylphenyl)-1-[4-(4-methyl-1-piperazinyl)cyclohexyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 3-(4-methylphenyl)-1-[4-(4-methylpiperazin-1-yl)cyclohexyl]pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-[4-(4-methylpiperazino)cyclohexyl]-3-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C23H31N7 MolecularWeight: 405.53914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C3=C2C(=NC=N3)N)C4CCC(CC4)N5CCN(CC5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C3=C2C(=NC=N3)N)C4CCC(CC4)N5CCN(CC5)C

InChI

InChI=1S/C23H31N7/c1-16-3-5-17(6-4-16)21-20-22(24)25-15-26-23(20)30(27-21)19-9-7-18(8-10-19)29-13-11-28(2)12-14-29/h3-6,15,18-19H,7-14H2,1-2H3,(H2,24,25,26)