2-ethyl-4-[2-(methylsulfonylmethyl)-4-(trifluoromethyl)phenyl]carbonyl-1H-pyrazol-3-one

Systemtic Name: 2-ethyl-4-[2-(methylsulfonylmethyl)-4-(trifluoromethyl)phenyl]carbonyl-1H-pyrazol-3-one Openeye Name: 2-ethyl-4-[2-(methylsulfonylmethyl)-4-(trifluoromethyl)benzoyl]-1H-pyrazol-3-one CAS Name: 2-ethyl-4-[[2-(methylsulfonylmethyl)-4-(trifluoromethyl)phenyl]-oxomethyl]-1H-pyrazol-3-one IUPAC Name: 2-ethyl-4-[2-(methylsulfonylmethyl)-4-(trifluoromethyl)benzoyl]-1H-pyrazol-3-one Traditional Name: 2-ethyl-4-[2-(mesylmethyl)-4-(trifluoromethyl)benzoyl]-3-pyrazolin-3-one Formula: C15H15F3N2O4S MolecularWeight: 376.35081

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(=CN1)C(=O)C2=C(C=C(C=C2)C(F)(F)F)CS(=O)(=O)C

Isomeric SMILES

CCN1C(=O)C(=CN1)C(=O)C2=C(C=C(C=C2)C(F)(F)F)CS(=O)(=O)C

InChI

InChI=1S/C15H15F3N2O4S/c1-3-20-14(22)12(7-19-20)13(21)11-5-4-10(15(16,17)18)6-9(11)8-25(2,23)24/h4-7,19H,3,8H2,1-2H3