4-bromanyl-N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]benzenesulfonamide Openeye Name: 4-bromo-N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-yl-ethyl]benzenesulfonamide CAS Name: 4-bromo-N-[2-(4-dimethylaminophenyl)-2-(1-pyrrolidinyl)ethyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[2-(4-dimethylaminophenyl)-2-pyrrolidin-1-ylethyl]benzenesulfonamide Traditional Name: 4-bromo-N-[2-(4-dimethylaminophenyl)-2-pyrrolidino-ethyl]benzenesulfonamide Formula: C20H26BrN3O2S MolecularWeight: 452.40834

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=C(C=C2)Br)N3CCCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=C(C=C2)Br)N3CCCC3

InChI

InChI=1S/C20H26BrN3O2S/c1-23(2)18-9-5-16(6-10-18)20(24-13-3-4-14-24)15-22-27(25,26)19-11-7-17(21)8-12-19/h5-12,20,22H,3-4,13-15H2,1-2H3