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

Systemtic Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide Openeye Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide CAS Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]-N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]propanamide IUPAC Name: 3-[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]propanamide Traditional Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]propionamide Formula: C25H35N6O3S+ MolecularWeight: 499.6488

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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)NC3=CC=C(C=C3)N4CC[NH+](CC4)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3=CC=C(C=C3)N4CC[NH+](CC4)C

InChI

InChI=1S/C25H34N6O3S/c1-5-31-23-11-10-21(35(33,34)28(2)3)18-22(23)27-24(31)12-13-25(32)26-19-6-8-20(9-7-19)30-16-14-29(4)15-17-30/h6-11,18H,5,12-17H2,1-4H3,(H,26,32)/p+1