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

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-3-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-N-methyl-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-3-(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)-N-methyl-propionamide Formula: C23H22BrN5O3 MolecularWeight: 496.35648

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)CCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)CCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

InChI

InChI=1S/C23H22BrN5O3/c1-28(14-15-12-16(24)8-9-19(15)32-2)21(30)11-10-20-26-22-18(23(31)27-20)13-25-29(22)17-6-4-3-5-7-17/h3-9,12-13,25H,10-11,14H2,1-2H3