5-[(5-ethanoyl-2-ethoxy-phenyl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(5-ethanoyl-2-ethoxy-phenyl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(5-acetyl-2-ethoxy-phenyl)methyl]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(5-acetyl-2-ethoxyphenyl)methyl]-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(5-acetyl-2-ethoxyphenyl)methyl]-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-(5-acetyl-2-ethoxy-benzyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O3/c1-3-29-20-10-9-16(15(2)27)11-17(20)13-25-14-23-21-19(22(25)28)12-24-26(21)18-7-5-4-6-8-18/h4-12,14H,3,13H2,1-2H3