2-[4-[2-(4-bromophenyl)quinolin-4-yl]carbonylpiperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[2-(4-bromophenyl)quinolin-4-yl]carbonylpiperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[2-(4-bromophenyl)quinoline-4-carbonyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[[2-(4-bromophenyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[2-(4-bromophenyl)quinoline-4-carbonyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[2-(4-bromophenyl)quinoline-4-carbonyl]piperazino]isonicotinonitrile Formula: C26H20BrN5O MolecularWeight: 498.3739

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br

Isomeric SMILES

C1CN(CCN1C2=NC=CC(=C2)C#N)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br

InChI

InChI=1S/C26H20BrN5O/c27-20-7-5-19(6-8-20)24-16-22(21-3-1-2-4-23(21)30-24)26(33)32-13-11-31(12-14-32)25-15-18(17-28)9-10-29-25/h1-10,15-16H,11-14H2