1-(4-bromophenyl)sulfonyl-N-[[2-(dimethylaminomethyl)phenyl]methyl]pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-bromophenyl)sulfonyl-N-[[2-(dimethylaminomethyl)phenyl]methyl]pyrrolidine-2-carboxamide Openeye Name: 1-(4-bromophenyl)sulfonyl-N-[[2-(dimethylaminomethyl)phenyl]methyl]pyrrolidine-2-carboxamide CAS Name: 1-(4-bromophenyl)sulfonyl-N-[[2-(dimethylaminomethyl)phenyl]methyl]-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-bromophenyl)sulfonyl-N-[[2-(dimethylaminomethyl)phenyl]methyl]pyrrolidine-2-carboxamide Traditional Name: 1-brosyl-N-[2-(dimethylaminomethyl)benzyl]pyrrolidine-2-carboxamide Formula: C21H26BrN3O3S MolecularWeight: 480.41844

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1CNC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(C)CC1=CC=CC=C1CNC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C21H26BrN3O3S/c1-24(2)15-17-7-4-3-6-16(17)14-23-21(26)20-8-5-13-25(20)29(27,28)19-11-9-18(22)10-12-19/h3-4,6-7,9-12,20H,5,8,13-15H2,1-2H3,(H,23,26)