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2-pyrimidin-2-ylsulfanyl-1-[3-[3-(trifluoromethyl)phenyl]carbonylpiperidin-1-yl]ethanone

2-pyrimidin-2-ylsulfanyl-1-[3-[3-(trifluoromethyl)phenyl]carbonylpiperidin-1-yl]ethanone

Systemtic Name:2-pyrimidin-2-ylsulfanyl-1-[3-[3-(trifluoromethyl)phenyl]carbonylpiperidin-1-yl]ethanone
Openeye Name:2-pyrimidin-2-ylsulfanyl-1-[3-[3-(trifluoromethyl)benzoyl]-1-piperidyl]ethanone
CAS Name:1-[3-[oxo-[3-(trifluoromethyl)phenyl]methyl]-1-piperidinyl]-2-(2-pyrimidinylthio)ethanone
IUPAC Name:2-pyrimidin-2-ylsulfanyl-1-[3-[3-(trifluoromethyl)benzoyl]piperidin-1-yl]ethanone
Traditional Name:2-(2-pyrimidylthio)-1-[3-[3-(trifluoromethyl)benzoyl]piperidino]ethanone
Formula: C19H18F3N3O2S
MolecularWeight: 409.42533
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CSC2=NC=CC=N2)C(=O)C3=CC(=CC=C3)C(F)(F)F


Isomeric SMILES

C1CC(CN(C1)C(=O)CSC2=NC=CC=N2)C(=O)C3=CC(=CC=C3)C(F)(F)F


InChI

InChI=1S/C19H18F3N3O2S/c20-19(21,22)15-6-1-4-13(10-15)17(27)14-5-2-9-25(11-14)16(26)12-28-18-23-7-3-8-24-18/h1,3-4,6-8,10,14H,2,5,9,11-12H2


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