methyl 4-[[3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoylamino]methyl]benzoate Openeye Name: methyl 4-[[3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoylamino]methyl]benzoate CAS Name: 4-[[[3-[5-(dimethylsulfamoyl)-1-methyl-2-benzimidazolyl]-1-oxopropyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-[5-(dimethylsulfamoyl)-1-methylbenzimidazol-2-yl]propanoylamino]methyl]benzoate Traditional Name: 4-[[3-[5-(dimethylsulfamoyl)-1-methyl-benzimidazol-2-yl]propanoylamino]methyl]benzoic acid methyl ester Formula: C22H26N4O5S MolecularWeight: 458.53064

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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=C(C=C3)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O5S/c1-25(2)32(29,30)17-9-10-19-18(13-17)24-20(26(19)3)11-12-21(27)23-14-15-5-7-16(8-6-15)22(28)31-4/h5-10,13H,11-12,14H2,1-4H3,(H,23,27)