3-[2-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]quinolin-8-yl]benzenecarbonitrile

Systemtic Name: 3-[2-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]quinolin-8-yl]benzenecarbonitrile Openeye Name: 3-[2-[4-[2-(2-pyridyl)ethyl]piperazin-1-yl]-8-quinolyl]benzonitrile CAS Name: 3-[2-[4-[2-(2-pyridinyl)ethyl]-1-piperazinyl]-8-quinolinyl]benzonitrile IUPAC Name: 3-[2-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]quinolin-8-yl]benzonitrile Traditional Name: 3-[2-[4-[2-(2-pyridyl)ethyl]piperazino]-8-quinolyl]benzonitrile Formula: C27H25N5 MolecularWeight: 419.5209

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=N2)C3=NC4=C(C=CC=C4C5=CC=CC(=C5)C#N)C=C3

Isomeric SMILES

C1CN(CCN1CCC2=CC=CC=N2)C3=NC4=C(C=CC=C4C5=CC=CC(=C5)C#N)C=C3

InChI

InChI=1S/C27H25N5/c28-20-21-5-3-7-23(19-21)25-9-4-6-22-10-11-26(30-27(22)25)32-17-15-31(16-18-32)14-12-24-8-1-2-13-29-24/h1-11,13,19H,12,14-18H2