1-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-one

Systemtic Name: 1-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-one Openeye Name: 1-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-2-pyridyl]piperidin-4-one CAS Name: 1-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-2-pyridinyl]-4-piperidinone IUPAC Name: 1-[3-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyridin-2-yl]piperidin-4-one Traditional Name: 1-[3-(4-mesylphenyl)-5-(trifluoromethyl)-2-pyridyl]-4-piperidone Formula: C18H17F3N2O3S MolecularWeight: 398.39939

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=CN=C2N3CCC(=O)CC3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=CN=C2N3CCC(=O)CC3)C(F)(F)F

InChI

InChI=1S/C18H17F3N2O3S/c1-27(25,26)15-4-2-12(3-5-15)16-10-13(18(19,20)21)11-22-17(16)23-8-6-14(24)7-9-23/h2-5,10-11H,6-9H2,1H3