N-(3,5-dimethoxyphenyl)-3-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-3-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide Openeye Name: N-(3,5-dimethoxyphenyl)-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide CAS Name: N-(3,5-dimethoxyphenyl)-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide IUPAC Name: N-(3,5-dimethoxyphenyl)-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide Traditional Name: N-(3,5-dimethoxyphenyl)-3-(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propionamide Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)CCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)CCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4)OC

InChI

InChI=1S/C22H21N5O4/c1-30-16-10-14(11-17(12-16)31-2)24-20(28)9-8-19-25-21-18(22(29)26-19)13-23-27(21)15-6-4-3-5-7-15/h3-7,10-13,23H,8-9H2,1-2H3,(H,24,28)