2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)-1-phenyl-3-[4-(phenylmethyl)piperazin-1-yl]propane-1,3-dione

Systemtic Name: 2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)-1-phenyl-3-[4-(phenylmethyl)piperazin-1-yl]propane-1,3-dione Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(5-bromo-2-oxo-1-pyridyl)-3-phenyl-propane-1,3-dione CAS Name: 2-(5-bromo-2-oxo-1-pyridinyl)-1-phenyl-3-[4-(phenylmethyl)-1-piperazinyl]propane-1,3-dione IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(5-bromo-2-oxopyridin-1-yl)-3-phenylpropane-1,3-dione Traditional Name: 1-(4-benzylpiperazino)-2-(5-bromo-2-keto-1-pyridyl)-3-phenyl-propane-1,3-dione Formula: C25H24BrN3O3 MolecularWeight: 494.38036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C(C(=O)C3=CC=CC=C3)N4C=C(C=CC4=O)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C(C(=O)C3=CC=CC=C3)N4C=C(C=CC4=O)Br

InChI

InChI=1S/C25H24BrN3O3/c26-21-11-12-22(30)29(18-21)23(24(31)20-9-5-2-6-10-20)25(32)28-15-13-27(14-16-28)17-19-7-3-1-4-8-19/h1-12,18,23H,13-17H2