2,5-bis(bromanyl)-N-[(3R,5S)-1-cyano-5-methyl-pyrrolidin-3-yl]-3,6-bis(fluoranyl)benzenesulfonamide

Systemtic Name: 2,5-bis(bromanyl)-N-[(3R,5S)-1-cyano-5-methyl-pyrrolidin-3-yl]-3,6-bis(fluoranyl)benzenesulfonamide Openeye Name: 2,5-dibromo-N-[(3R,5S)-1-cyano-5-methyl-pyrrolidin-3-yl]-3,6-difluoro-benzenesulfonamide CAS Name: 2,5-dibromo-N-[(3R,5S)-1-cyano-5-methyl-3-pyrrolidinyl]-3,6-difluorobenzenesulfonamide IUPAC Name: 2,5-dibromo-N-[(3R,5S)-1-cyano-5-methylpyrrolidin-3-yl]-3,6-difluorobenzenesulfonamide Traditional Name: 2,5-dibromo-N-[(3R,5S)-1-cyano-5-methyl-pyrrolidin-3-yl]-3,6-difluoro-benzenesulfonamide Formula: C12H11Br2F2N3O2S MolecularWeight: 459.104446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11Br2F2N3O2S/c1-6-2-7(4-19(6)5-17)18-22(20,21)12-10(14)9(15)3-8(13)11(12)16/h3,6-7,18H,2,4H2,1H3/t6-,7+/m0/s1