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

Systemtic Name: N-[2-(4-bromanylphenoxy)ethyl]-N-methyl-3-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide Openeye Name: N-[2-(4-bromophenoxy)ethyl]-N-methyl-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide CAS Name: N-[2-(4-bromophenoxy)ethyl]-N-methyl-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide IUPAC Name: N-[2-(4-bromophenoxy)ethyl]-N-methyl-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide Traditional Name: N-[2-(4-bromophenoxy)ethyl]-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(CCOC1=CC=C(C=C1)Br)C(=O)CCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

Isomeric SMILES

CN(CCOC1=CC=C(C=C1)Br)C(=O)CCC2=NC(=O)C3=CNN(C3=N2)C4=CC=CC=C4

InChI

InChI=1S/C23H22BrN5O3/c1-28(13-14-32-18-9-7-16(24)8-10-18)21(30)12-11-20-26-22-19(23(31)27-20)15-25-29(22)17-5-3-2-4-6-17/h2-10,15,25H,11-14H2,1H3