3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-(2-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-(2-methyl-3-nitro-phenyl)propanamide Openeye Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-(2-methyl-3-nitro-phenyl)propanamide CAS Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]-N-(2-methyl-3-nitrophenyl)propanamide IUPAC Name: 3-[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]-N-(2-methyl-3-nitrophenyl)propanamide Traditional Name: 3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]-N-(2-methyl-3-nitro-phenyl)propionamide Formula: C21H25N5O5S MolecularWeight: 459.5187

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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)NC3=C(C(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3=C(C(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C21H25N5O5S/c1-5-25-19-10-9-15(32(30,31)24(3)4)13-17(19)22-20(25)11-12-21(27)23-16-7-6-8-18(14(16)2)26(28)29/h6-10,13H,5,11-12H2,1-4H3,(H,23,27)