3-[[4-[8-phenyl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-[8-phenyl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[4-[8-phenyl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperazin-1-yl]methyl]benzonitrile CAS Name: 3-[[4-[8-phenyl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 3-[[4-[8-phenyl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 3-[[4-[8-phenyl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperazino]methyl]benzonitrile Formula: C27H22F3N5 MolecularWeight: 473.49229

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC(=C2)C#N)C3=NC=C(C4=C3C=CC(=N4)C(F)(F)F)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC(=C2)C#N)C3=NC=C(C4=C3C=CC(=N4)C(F)(F)F)C5=CC=CC=C5

InChI

InChI=1S/C27H22F3N5/c28-27(29,30)24-10-9-22-25(33-24)23(21-7-2-1-3-8-21)17-32-26(22)35-13-11-34(12-14-35)18-20-6-4-5-19(15-20)16-31/h1-10,15,17H,11-14,18H2