2-[3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoylamino]ethyl-diisopropyl-ammonium CAS Name: 2-[[3-[5-(dimethylsulfamoyl)-1-methyl-2-benzimidazolyl]-1-oxopropyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[3-[5-(dimethylsulfamoyl)-1-methylbenzimidazol-2-yl]propanoylamino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoylamino]ethyl-diisopropyl-ammonium Formula: C21H36N5O3S+ MolecularWeight: 438.60724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)CCC1=NC2=C(N1C)C=CC(=C2)S(=O)(=O)N(C)C)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)CCC1=NC2=C(N1C)C=CC(=C2)S(=O)(=O)N(C)C)C(C)C

InChI

InChI=1S/C21H35N5O3S/c1-15(2)26(16(3)4)13-12-22-21(27)11-10-20-23-18-14-17(30(28,29)24(5)6)8-9-19(18)25(20)7/h8-9,14-16H,10-13H2,1-7H3,(H,22,27)/p+1