2-bromanyl-N-[(3R,5R)-1-cyano-5-(methoxymethyl)pyrrolidin-3-yl]-5-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 2-bromanyl-N-[(3R,5R)-1-cyano-5-(methoxymethyl)pyrrolidin-3-yl]-5-(trifluoromethyl)benzenesulfonamide Openeye Name: 2-bromo-N-[(3R,5R)-1-cyano-5-(methoxymethyl)pyrrolidin-3-yl]-5-(trifluoromethyl)benzenesulfonamide CAS Name: 2-bromo-N-[(3R,5R)-1-cyano-5-(methoxymethyl)-3-pyrrolidinyl]-5-(trifluoromethyl)benzenesulfonamide IUPAC Name: 2-bromo-N-[(3R,5R)-1-cyano-5-(methoxymethyl)pyrrolidin-3-yl]-5-(trifluoromethyl)benzenesulfonamide Traditional Name: 2-bromo-N-[(3R,5R)-1-cyano-5-(methoxymethyl)pyrrolidin-3-yl]-5-(trifluoromethyl)benzenesulfonamide Formula: C14H15BrF3N3O3S MolecularWeight: 442.25141

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Descriptors Computed from Structure

Canonical SMILES:

COCC1CC(CN1C#N)NS(=O)(=O)C2=C(C=CC(=C2)C(F)(F)F)Br

Isomeric SMILES

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

InChI

InChI=1S/C14H15BrF3N3O3S/c1-24-7-11-5-10(6-21(11)8-19)20-25(22,23)13-4-9(14(16,17)18)2-3-12(13)15/h2-4,10-11,20H,5-7H2,1H3/t10-,11-/m1/s1