5-(dimethylsulfamoyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-(dimethylsulfamoyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-(dimethylsulfamoyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-2-pyrrolidin-1-yl-benzamide CAS Name: 5-(dimethylsulfamoyl)-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-(dimethylsulfamoyl)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-(dimethylsulfamoyl)-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]-2-pyrrolidino-benzamide Formula: C26H37N4O3S+ MolecularWeight: 485.66198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)NCC3=CC=CC=C3C[NH+]4CCCCC4

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)N2CCCC2)C(=O)NCC3=CC=CC=C3C[NH+]4CCCCC4

InChI

InChI=1S/C26H36N4O3S/c1-28(2)34(32,33)23-12-13-25(30-16-8-9-17-30)24(18-23)26(31)27-19-21-10-4-5-11-22(21)20-29-14-6-3-7-15-29/h4-5,10-13,18H,3,6-9,14-17,19-20H2,1-2H3,(H,27,31)/p+1