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

Systemtic Name: 1-cyclohexyl-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrazolo[3,4-d]pyrimidin-6-amine Openeye Name: 1-cyclohexyl-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrazolo[3,4-d]pyrimidin-6-amine CAS Name: 1-cyclohexyl-N-[4-[(4-methyl-1-piperazinyl)methyl]phenyl]-6-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-cyclohexyl-N-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]pyrazolo[3,4-d]pyrimidin-6-amine Traditional Name: (1-cyclohexylpyrazolo[3,4-d]pyrimidin-6-yl)-[4-[(4-methylpiperazino)methyl]phenyl]amine Formula: C23H31N7 MolecularWeight: 405.53914

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=C(C=C2)NC3=NC=C4C=NN(C4=N3)C5CCCCC5

Isomeric SMILES

CN1CCN(CC1)CC2=CC=C(C=C2)NC3=NC=C4C=NN(C4=N3)C5CCCCC5

InChI

InChI=1S/C23H31N7/c1-28-11-13-29(14-12-28)17-18-7-9-20(10-8-18)26-23-24-15-19-16-25-30(22(19)27-23)21-5-3-2-4-6-21/h7-10,15-16,21H,2-6,11-14,17H2,1H3,(H,24,26,27)