[(3R)-1-ethylsulfonylpiperidin-3-yl]-[(5R)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone

Systemtic Name: [(3R)-1-ethylsulfonylpiperidin-3-yl]-[(5R)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Openeye Name: [(3R)-1-ethylsulfonyl-3-piperidyl]-[(5R)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone CAS Name: [(3R)-1-ethylsulfonyl-3-piperidinyl]-[(5R)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone IUPAC Name: [(3R)-1-ethylsulfonylpiperidin-3-yl]-[(5R)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]methanone Traditional Name: [(3R)-1-esyl-3-piperidyl]-[(5R)-5-hydroxy-3-methyl-5-(trifluoromethyl)-2-pyrazolin-1-yl]methanone Formula: C13H20F3N3O4S MolecularWeight: 371.37581

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCCC(C1)C(=O)N2C(CC(=N2)C)(C(F)(F)F)O

Isomeric SMILES

CCS(=O)(=O)N1CCC[C@H](C1)C(=O)N2[C@@](CC(=N2)C)(C(F)(F)F)O

InChI

InChI=1S/C13H20F3N3O4S/c1-3-24(22,23)18-6-4-5-10(8-18)11(20)19-12(21,13(14,15)16)7-9(2)17-19/h10,21H,3-8H2,1-2H3/t10-,12-/m1/s1