N-(3,4-dimethylphenyl)-6-[(3S)-3-methylpiperidin-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(3,4-dimethylphenyl)-6-[(3S)-3-methylpiperidin-1-yl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3,4-dimethylphenyl)-6-[(3S)-3-methyl-1-piperidyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3,4-dimethylphenyl)-6-[(3S)-3-methyl-1-piperidinyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(3,4-dimethylphenyl)-6-[(3S)-3-methylpiperidin-1-yl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (3,4-dimethylphenyl)-[6-[(3S)-3-methylpiperidino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C25H28N6 MolecularWeight: 412.53002

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=NC3=C(C=NN3C4=CC=CC=C4)C(=N2)NC5=CC(=C(C=C5)C)C

Isomeric SMILES

C[C@H]1CCCN(C1)C2=NC3=C(C=NN3C4=CC=CC=C4)C(=N2)NC5=CC(=C(C=C5)C)C

InChI

InChI=1S/C25H28N6/c1-17-8-7-13-30(16-17)25-28-23(27-20-12-11-18(2)19(3)14-20)22-15-26-31(24(22)29-25)21-9-5-4-6-10-21/h4-6,9-12,14-15,17H,7-8,13,16H2,1-3H3,(H,27,28,29)/t17-/m0/s1