2-[2-oxidanylidene-5-pyridin-2-yl-1-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridin-3-yl]benzenecarbonitrile

Systemtic Name: 2-[2-oxidanylidene-5-pyridin-2-yl-1-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridin-3-yl]benzenecarbonitrile Openeye Name: 2-[2-oxo-5-(2-pyridyl)-1-[3-(pyrrolidin-1-ylmethyl)phenyl]-3-pyridyl]benzonitrile CAS Name: 2-[2-oxo-5-(2-pyridinyl)-1-[3-(1-pyrrolidinylmethyl)phenyl]-3-pyridinyl]benzonitrile IUPAC Name: 2-[2-oxo-5-pyridin-2-yl-1-[3-(pyrrolidin-1-ylmethyl)phenyl]pyridin-3-yl]benzonitrile Traditional Name: 2-[2-keto-5-(2-pyridyl)-1-[3-(pyrrolidinomethyl)phenyl]-3-pyridyl]benzonitrile Formula: C28H24N4O MolecularWeight: 432.51636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC(=CC=C2)N3C=C(C=C(C3=O)C4=CC=CC=C4C#N)C5=CC=CC=N5

Isomeric SMILES

C1CCN(C1)CC2=CC(=CC=C2)N3C=C(C=C(C3=O)C4=CC=CC=C4C#N)C5=CC=CC=N5

InChI

InChI=1S/C28H24N4O/c29-18-22-9-1-2-11-25(22)26-17-23(27-12-3-4-13-30-27)20-32(28(26)33)24-10-7-8-21(16-24)19-31-14-5-6-15-31/h1-4,7-13,16-17,20H,5-6,14-15,19H2