4,4,4-tris(fluoranyl)-1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]butan-1-one

Systemtic Name: 4,4,4-tris(fluoranyl)-1-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]butan-1-one Openeye Name: 4,4,4-trifluoro-1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]butan-1-one CAS Name: 4,4,4-trifluoro-1-[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-1-butanone IUPAC Name: 4,4,4-trifluoro-1-[2-(2-methylsulfonylbenzoyl)pyrazolidin-1-yl]butan-1-one Traditional Name: 4,4,4-trifluoro-1-[2-(2-mesylbenzoyl)pyrazolidin-1-yl]butan-1-one Formula: C15H17F3N2O4S MolecularWeight: 378.36669

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CCC(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)CCC(F)(F)F

InChI

InChI=1S/C15H17F3N2O4S/c1-25(23,24)12-6-3-2-5-11(12)14(22)20-10-4-9-19(20)13(21)7-8-15(16,17)18/h2-3,5-6H,4,7-10H2,1H3