3-[[3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoylamino]methyl]benzamide

Systemtic Name: 3-[[3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoylamino]methyl]benzamide Openeye Name: 3-[[3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoylamino]methyl]benzamide CAS Name: 3-[[[3-[5-(dimethylsulfamoyl)-1-methyl-2-benzimidazolyl]-1-oxopropyl]amino]methyl]benzamide IUPAC Name: 3-[[3-[5-(dimethylsulfamoyl)-1-methylbenzimidazol-2-yl]propanoylamino]methyl]benzamide Traditional Name: 3-[[3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoylamino]methyl]benzamide Formula: C21H25N5O4S MolecularWeight: 443.5193

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NCC3=CC=CC(=C3)C(=O)N

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NCC3=CC=CC(=C3)C(=O)N

InChI

InChI=1S/C21H25N5O4S/c1-25(2)31(29,30)16-7-8-18-17(12-16)24-19(26(18)3)9-10-20(27)23-13-14-5-4-6-15(11-14)21(22)28/h4-8,11-12H,9-10,13H2,1-3H3,(H2,22,28)(H,23,27)