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

Systemtic Name: 5-[(5-ethanoyl-2-methoxy-phenyl)methyl]-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(5-acetyl-2-methoxy-phenyl)methyl]-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(5-acetyl-2-methoxyphenyl)methyl]-1-(4-fluorophenyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(5-acetyl-2-methoxyphenyl)methyl]-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-(5-acetyl-2-methoxy-benzyl)-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H17FN4O3 MolecularWeight: 392.383083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17FN4O3/c1-13(27)14-3-8-19(29-2)15(9-14)11-25-12-23-20-18(21(25)28)10-24-26(20)17-6-4-16(22)5-7-17/h3-10,12H,11H2,1-2H3