6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-1-methyl-N-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-1-methyl-N-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-1-methyl-N-phenyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 6-[(2S,6S)-2,6-dimethyl-4-morpholinyl]-1-methyl-N-phenyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 6-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-1-methyl-N-phenylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [6-[(2S,6S)-2,6-dimethylmorpholino]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]-phenyl-amine Formula: C18H22N6O MolecularWeight: 338.40688

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=NC3=C(C=NN3C)C(=N2)NC4=CC=CC=C4

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)C2=NC3=C(C=NN3C)C(=N2)NC4=CC=CC=C4

InChI

InChI=1S/C18H22N6O/c1-12-10-24(11-13(2)25-12)18-21-16(20-14-7-5-4-6-8-14)15-9-19-23(3)17(15)22-18/h4-9,12-13H,10-11H2,1-3H3,(H,20,21,22)/t12-,13-/m0/s1