3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]propanoate

Systemtic Name: 3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]propanoate Openeye Name: 3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]propanoate CAS Name: 3-[1-butyl-5-(dimethylsulfamoyl)-2-benzimidazolyl]propanoate IUPAC Name: 3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]propanoate Traditional Name: 3-[1-butyl-5-(dimethylsulfamoyl)benzimidazol-2-yl]propionate Formula: C16H22N3O4S- MolecularWeight: 352.42858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)[O-]

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)[O-]

InChI

InChI=1S/C16H23N3O4S/c1-4-5-10-19-14-7-6-12(24(22,23)18(2)3)11-13(14)17-15(19)8-9-16(20)21/h6-7,11H,4-5,8-10H2,1-3H3,(H,20,21)/p-1