3-(1,2-dipyridin-3-yl-2-pyrimidin-2-yl-ethyl)benzenecarbonitrile

Systemtic Name: 3-(1,2-dipyridin-3-yl-2-pyrimidin-2-yl-ethyl)benzenecarbonitrile Openeye Name: 3-[1,2-bis(3-pyridyl)-2-pyrimidin-2-yl-ethyl]benzonitrile CAS Name: 3-[1,2-bis(3-pyridinyl)-2-(2-pyrimidinyl)ethyl]benzonitrile IUPAC Name: 3-(1,2-dipyridin-3-yl-2-pyrimidin-2-ylethyl)benzonitrile Traditional Name: 3-[1,2-bis(3-pyridyl)-2-(2-pyrimidyl)ethyl]benzonitrile Formula: C23H17N5 MolecularWeight: 363.41458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(C2=CN=CC=C2)C(C3=CN=CC=C3)C4=NC=CC=N4)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(C2=CN=CC=C2)C(C3=CN=CC=C3)C4=NC=CC=N4)C#N

InChI

InChI=1S/C23H17N5/c24-14-17-5-1-6-18(13-17)21(19-7-2-9-25-15-19)22(20-8-3-10-26-16-20)23-27-11-4-12-28-23/h1-13,15-16,21-22H