3-[4-[(3-methoxyphenyl)methylamino]phenyl]-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 3-[4-[(3-methoxyphenyl)methylamino]phenyl]-1-piperidin-4-yl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 3-[4-[(3-methoxyphenyl)methylamino]phenyl]-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 3-[4-[(3-methoxyphenyl)methylamino]phenyl]-1-(4-piperidinyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 3-[4-[(3-methoxyphenyl)methylamino]phenyl]-1-piperidin-4-ylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [4-[4-amino-1-(4-piperidyl)pyrazolo[3,4-d]pyrimidin-3-yl]phenyl]-m-anisyl-amine Formula: C24H27N7O MolecularWeight: 429.51748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC2=CC=C(C=C2)C3=NN(C4=C3C(=NC=N4)N)C5CCNCC5

Isomeric SMILES

COC1=CC=CC(=C1)CNC2=CC=C(C=C2)C3=NN(C4=C3C(=NC=N4)N)C5CCNCC5

InChI

InChI=1S/C24H27N7O/c1-32-20-4-2-3-16(13-20)14-27-18-7-5-17(6-8-18)22-21-23(25)28-15-29-24(21)31(30-22)19-9-11-26-12-10-19/h2-8,13,15,19,26-27H,9-12,14H2,1H3,(H2,25,28,29)