N-[5-methyl-2-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)pyrazol-3-yl]adamantane-1-carboxamide

Systemtic Name: N-[5-methyl-2-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)pyrazol-3-yl]adamantane-1-carboxamide Openeye Name: N-[5-methyl-2-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)pyrazol-3-yl]adamantane-1-carboxamide CAS Name: N-[5-methyl-2-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-3-pyrazolyl]-1-adamantanecarboxamide IUPAC Name: N-[5-methyl-2-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)pyrazol-3-yl]adamantane-1-carboxamide Traditional Name: N-[2-(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-5-methyl-pyrazol-3-yl]adamantane-1-carboxamide Formula: C26H27N7O2 MolecularWeight: 469.53828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C23CC4CC(C2)CC(C4)C3)C5=NC(=O)C6=CNN(C6=N5)C7=CC=CC=C7

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C23CC4CC(C2)CC(C4)C3)C5=NC(=O)C6=CNN(C6=N5)C7=CC=CC=C7

InChI

InChI=1S/C26H27N7O2/c1-15-7-21(28-24(35)26-11-16-8-17(12-26)10-18(9-16)13-26)33(31-15)25-29-22-20(23(34)30-25)14-27-32(22)19-5-3-2-4-6-19/h2-7,14,16-18,27H,8-13H2,1H3,(H,28,35)