3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]propanamide

Systemtic Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]propanamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanamide CAS Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]propanamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]propanamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propionamide Formula: C26H36N5O3S+ MolecularWeight: 498.66074

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H35N5O3S/c1-4-31-24-11-10-22(35(33,34)29(2)3)18-23(24)28-25(31)12-13-26(32)27-21-14-16-30(17-15-21)19-20-8-6-5-7-9-20/h5-11,18,21H,4,12-17,19H2,1-3H3,(H,27,32)/p+1