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

Systemtic Name: 3-[[3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanoylamino]methyl]benzamide Openeye Name: 3-[[3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanoylamino]methyl]benzamide CAS Name: 3-[[[3-[5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]-1-oxopropyl]amino]methyl]benzamide IUPAC Name: 3-[[3-[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]propanoylamino]methyl]benzamide Traditional Name: 3-[[3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanoylamino]methyl]benzamide Formula: C22H27N5O4S MolecularWeight: 457.54588

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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)NCC3=CC=CC(=C3)C(=O)N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NCC3=CC=CC(=C3)C(=O)N

InChI

InChI=1S/C22H27N5O4S/c1-4-27-19-9-8-17(32(30,31)26(2)3)13-18(19)25-20(27)10-11-21(28)24-14-15-6-5-7-16(12-15)22(23)29/h5-9,12-13H,4,10-11,14H2,1-3H3,(H2,23,29)(H,24,28)