2-[4-[(4-ethanoylpiperazin-1-yl)methyl]-2-oxidanylidene-1-phenyl-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile

Systemtic Name: 2-[4-[(4-ethanoylpiperazin-1-yl)methyl]-2-oxidanylidene-1-phenyl-5-pyridin-2-yl-pyridin-3-yl]benzenecarbonitrile Openeye Name: 2-[4-[(4-acetylpiperazin-1-yl)methyl]-2-oxo-1-phenyl-5-(2-pyridyl)-3-pyridyl]benzonitrile CAS Name: 2-[4-[(4-acetyl-1-piperazinyl)methyl]-2-oxo-1-phenyl-5-(2-pyridinyl)-3-pyridinyl]benzonitrile IUPAC Name: 2-[4-[(4-acetylpiperazin-1-yl)methyl]-2-oxo-1-phenyl-5-pyridin-2-ylpyridin-3-yl]benzonitrile Traditional Name: 2-[4-[(4-acetylpiperazino)methyl]-2-keto-1-phenyl-5-(2-pyridyl)-3-pyridyl]benzonitrile Formula: C30H27N5O2 MolecularWeight: 489.56768

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)CC2=C(C(=O)N(C=C2C3=CC=CC=N3)C4=CC=CC=C4)C5=CC=CC=C5C#N

Isomeric SMILES

CC(=O)N1CCN(CC1)CC2=C(C(=O)N(C=C2C3=CC=CC=N3)C4=CC=CC=C4)C5=CC=CC=C5C#N

InChI

InChI=1S/C30H27N5O2/c1-22(36)34-17-15-33(16-18-34)20-27-26(28-13-7-8-14-32-28)21-35(24-10-3-2-4-11-24)30(37)29(27)25-12-6-5-9-23(25)19-31/h2-14,21H,15-18,20H2,1H3