(6-bromanyl-2-phenyl-quinolin-4-yl)-[4-(2,5-dimethylphenyl)piperazin-1-yl]methanone

Systemtic Name: (6-bromanyl-2-phenyl-quinolin-4-yl)-[4-(2,5-dimethylphenyl)piperazin-1-yl]methanone Openeye Name: (6-bromo-2-phenyl-4-quinolyl)-[4-(2,5-dimethylphenyl)piperazin-1-yl]methanone CAS Name: (6-bromo-2-phenyl-4-quinolinyl)-[4-(2,5-dimethylphenyl)-1-piperazinyl]methanone IUPAC Name: (6-bromo-2-phenylquinolin-4-yl)-[4-(2,5-dimethylphenyl)piperazin-1-yl]methanone Traditional Name: (6-bromo-2-phenyl-4-quinolyl)-[4-(2,5-dimethylphenyl)piperazino]methanone Formula: C28H26BrN3O MolecularWeight: 500.42954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C28H26BrN3O/c1-19-8-9-20(2)27(16-19)31-12-14-32(15-13-31)28(33)24-18-26(21-6-4-3-5-7-21)30-25-11-10-22(29)17-23(24)25/h3-11,16-18H,12-15H2,1-2H3