5-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-keto-2-(2,4,5-trimethylphenyl)ethyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)CN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)CN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4)C)C

InChI

InChI=1S/C22H20N4O2/c1-14-9-16(3)18(10-15(14)2)20(27)12-25-13-23-21-19(22(25)28)11-24-26(21)17-7-5-4-6-8-17/h4-11,13H,12H2,1-3H3