2-[2-[3-(trifluoromethyl)piperidin-1-yl]carbonylphenyl]sulfanylbenzenecarbonitrile

Systemtic Name: 2-[2-[3-(trifluoromethyl)piperidin-1-yl]carbonylphenyl]sulfanylbenzenecarbonitrile Openeye Name: 2-[2-[3-(trifluoromethyl)piperidine-1-carbonyl]phenyl]sulfanylbenzonitrile CAS Name: 2-[[2-[oxo-[3-(trifluoromethyl)-1-piperidinyl]methyl]phenyl]thio]benzonitrile IUPAC Name: 2-[2-[3-(trifluoromethyl)piperidine-1-carbonyl]phenyl]sulfanylbenzonitrile Traditional Name: 2-[[2-[3-(trifluoromethyl)piperidine-1-carbonyl]phenyl]thio]benzonitrile Formula: C20H17F3N2OS MolecularWeight: 390.42199

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)C(F)(F)F

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)C(F)(F)F

InChI

InChI=1S/C20H17F3N2OS/c21-20(22,23)15-7-5-11-25(13-15)19(26)16-8-2-4-10-18(16)27-17-9-3-1-6-14(17)12-24/h1-4,6,8-10,15H,5,7,11,13H2