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

Systemtic Name: [(5S)-3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(1-methylsulfonylpiperidin-4-yl)methanone Openeye Name: [(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(1-methylsulfonyl-4-piperidyl)methanone CAS Name: [(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(1-methylsulfonyl-4-piperidinyl)methanone IUPAC Name: [(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-(1-methylsulfonylpiperidin-4-yl)methanone Traditional Name: [(5S)-5-hydroxy-3-methyl-5-(trifluoromethyl)-2-pyrazolin-1-yl]-(1-mesyl-4-piperidyl)methanone Formula: C12H18F3N3O4S MolecularWeight: 357.34923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C2CCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC1=NN([C@](C1)(C(F)(F)F)O)C(=O)C2CCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C12H18F3N3O4S/c1-8-7-11(20,12(13,14)15)18(16-8)10(19)9-3-5-17(6-4-9)23(2,21)22/h9,20H,3-7H2,1-2H3/t11-/m0/s1