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

Systemtic Name: N-[1-(4-bromophenyl)ethyl]-3-(4-oxidanylidene-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide Openeye Name: N-[1-(4-bromophenyl)ethyl]-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide CAS Name: N-[1-(4-bromophenyl)ethyl]-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide IUPAC Name: N-[1-(4-bromophenyl)ethyl]-3-(4-oxo-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propanamide Traditional Name: N-[1-(4-bromophenyl)ethyl]-3-(4-keto-1-phenyl-2H-pyrazolo[3,4-d]pyrimidin-6-yl)propionamide Formula: C22H20BrN5O2 MolecularWeight: 466.3305

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20BrN5O2/c1-14(15-7-9-16(23)10-8-15)25-20(29)12-11-19-26-21-18(22(30)27-19)13-24-28(21)17-5-3-2-4-6-17/h2-10,13-14,24H,11-12H2,1H3,(H,25,29)