5-bromanyl-N-[(3R)-1-cyanopyrrolidin-3-yl]-2-methoxy-N-methyl-benzenesulfonamide

Systemtic Name: 5-bromanyl-N-[(3R)-1-cyanopyrrolidin-3-yl]-2-methoxy-N-methyl-benzenesulfonamide Openeye Name: 5-bromo-N-[(3R)-1-cyanopyrrolidin-3-yl]-2-methoxy-N-methyl-benzenesulfonamide CAS Name: 5-bromo-N-[(3R)-1-cyano-3-pyrrolidinyl]-2-methoxy-N-methylbenzenesulfonamide IUPAC Name: 5-bromo-N-[(3R)-1-cyanopyrrolidin-3-yl]-2-methoxy-N-methylbenzenesulfonamide Traditional Name: 5-bromo-N-[(3R)-1-cyanopyrrolidin-3-yl]-2-methoxy-N-methyl-benzenesulfonamide Formula: C13H16BrN3O3S MolecularWeight: 374.25344

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(C1)C#N)S(=O)(=O)C2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CN([C@@H]1CCN(C1)C#N)S(=O)(=O)C2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C13H16BrN3O3S/c1-16(11-5-6-17(8-11)9-15)21(18,19)13-7-10(14)3-4-12(13)20-2/h3-4,7,11H,5-6,8H2,1-2H3/t11-/m1/s1