N-[(3R,5S)-1-cyano-5-methyl-pyrrolidin-3-yl]-2,3,5-tris(fluoranyl)benzenesulfonamide

Systemtic Name: N-[(3R,5S)-1-cyano-5-methyl-pyrrolidin-3-yl]-2,3,5-tris(fluoranyl)benzenesulfonamide Openeye Name: N-[(3R,5S)-1-cyano-5-methyl-pyrrolidin-3-yl]-2,3,5-trifluoro-benzenesulfonamide CAS Name: N-[(3R,5S)-1-cyano-5-methyl-3-pyrrolidinyl]-2,3,5-trifluorobenzenesulfonamide IUPAC Name: N-[(3R,5S)-1-cyano-5-methylpyrrolidin-3-yl]-2,3,5-trifluorobenzenesulfonamide Traditional Name: N-[(3R,5S)-1-cyano-5-methyl-pyrrolidin-3-yl]-2,3,5-trifluoro-benzenesulfonamide Formula: C12H12F3N3O2S MolecularWeight: 319.30279

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN1C#N)NS(=O)(=O)C2=CC(=CC(=C2F)F)F

Isomeric SMILES

C[C@H]1C[C@H](CN1C#N)NS(=O)(=O)C2=CC(=CC(=C2F)F)F

InChI

InChI=1S/C12H12F3N3O2S/c1-7-2-9(5-18(7)6-16)17-21(19,20)11-4-8(13)3-10(14)12(11)15/h3-4,7,9,17H,2,5H2,1H3/t7-,9+/m0/s1