N-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide

Systemtic Name: N-[(4-fluoranyl-3-methyl-phenyl)methyl]-3-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide Openeye Name: N-[(4-fluoro-3-methyl-phenyl)methyl]-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide CAS Name: N-[(4-fluoro-3-methylphenyl)methyl]-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide IUPAC Name: N-[(4-fluoro-3-methylphenyl)methyl]-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide Traditional Name: N-(4-fluoro-3-methyl-benzyl)-3-(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propionamide Formula: C22H20FN5O2 MolecularWeight: 405.424903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)CCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)CCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4)F

InChI

InChI=1S/C22H20FN5O2/c1-14-11-15(7-8-18(14)23)12-24-20(29)10-9-19-26-21-17(22(30)27-19)13-25-28(21)16-5-3-2-4-6-16/h2-8,11,13,25H,9-10,12H2,1H3,(H,24,29)