3-[3,5-bis(2-cyano-2-pyridin-3-yl-ethyl)phenyl]-2-pyridin-3-yl-propanenitrile

Systemtic Name: 3-[3,5-bis(2-cyano-2-pyridin-3-yl-ethyl)phenyl]-2-pyridin-3-yl-propanenitrile Openeye Name: 3-[3,5-bis[2-cyano-2-(3-pyridyl)ethyl]phenyl]-2-(3-pyridyl)propanenitrile CAS Name: 3-[3,5-bis[2-cyano-2-(3-pyridinyl)ethyl]phenyl]-2-(3-pyridinyl)propanenitrile IUPAC Name: 3-[3,5-bis(2-cyano-2-pyridin-3-ylethyl)phenyl]-2-pyridin-3-ylpropanenitrile Traditional Name: 3-[3,5-bis[2-cyano-2-(3-pyridyl)ethyl]phenyl]-2-(3-pyridyl)propionitrile Formula: C30H24N6 MolecularWeight: 468.55176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(CC2=CC(=CC(=C2)CC(C#N)C3=CN=CC=C3)CC(C#N)C4=CN=CC=C4)C#N

Isomeric SMILES

C1=CC(=CN=C1)C(CC2=CC(=CC(=C2)CC(C#N)C3=CN=CC=C3)CC(C#N)C4=CN=CC=C4)C#N

InChI

InChI=1S/C30H24N6/c31-16-28(25-4-1-7-34-19-25)13-22-10-23(14-29(17-32)26-5-2-8-35-20-26)12-24(11-22)15-30(18-33)27-6-3-9-36-21-27/h1-12,19-21,28-30H,13-15H2