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

Systemtic Name: 3-(4-methoxyphenyl)-N-[(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl]propanamide Openeye Name: 3-(4-methoxyphenyl)-N-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl]propanamide CAS Name: 3-(4-methoxyphenyl)-N-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl]propanamide IUPAC Name: 3-(4-methoxyphenyl)-N-[(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl]propanamide Traditional Name: N-[(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl]-3-(4-methoxyphenyl)propionamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)NCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)NCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

InChI

InChI=1S/C22H21N5O3/c1-30-17-10-7-15(8-11-17)9-12-20(28)23-14-19-25-21-18(22(29)26-19)13-24-27(21)16-5-3-2-4-6-16/h2-8,10-11,13,24H,9,12,14H2,1H3,(H,23,28)