5-phenyl-6-[4-[[4-(3-pyridin-2-yl-1H-1,2,4-triazol-5-yl)piperidin-1-yl]methyl]phenyl]pyridine-3-carbonitrile

Systemtic Name: 5-phenyl-6-[4-[[4-(3-pyridin-2-yl-1H-1,2,4-triazol-5-yl)piperidin-1-yl]methyl]phenyl]pyridine-3-carbonitrile Openeye Name: 5-phenyl-6-[4-[[4-[3-(2-pyridyl)-1H-1,2,4-triazol-5-yl]-1-piperidyl]methyl]phenyl]pyridine-3-carbonitrile CAS Name: 5-phenyl-6-[4-[[4-[3-(2-pyridinyl)-1H-1,2,4-triazol-5-yl]-1-piperidinyl]methyl]phenyl]-3-pyridinecarbonitrile IUPAC Name: 5-phenyl-6-[4-[[4-(3-pyridin-2-yl-1H-1,2,4-triazol-5-yl)piperidin-1-yl]methyl]phenyl]pyridine-3-carbonitrile Traditional Name: 5-phenyl-6-[4-[[4-[3-(2-pyridyl)-1H-1,2,4-triazol-5-yl]piperidino]methyl]phenyl]nicotinonitrile Formula: C31H27N7 MolecularWeight: 497.59298

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=NN2)C3=CC=CC=N3)CC4=CC=C(C=C4)C5=C(C=C(C=N5)C#N)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1C2=NC(=NN2)C3=CC=CC=N3)CC4=CC=C(C=C4)C5=C(C=C(C=N5)C#N)C6=CC=CC=C6

InChI

InChI=1S/C31H27N7/c32-19-23-18-27(24-6-2-1-3-7-24)29(34-20-23)25-11-9-22(10-12-25)21-38-16-13-26(14-17-38)30-35-31(37-36-30)28-8-4-5-15-33-28/h1-12,15,18,20,26H,13-14,16-17,21H2,(H,35,36,37)