N-(4-bromanyl-3-methyl-phenyl)-3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propanamide CAS Name: N-(4-bromo-3-methylphenyl)-3-[5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]propanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-3-[5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]propanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-3-[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]propionamide Formula: C21H25BrN4O3S MolecularWeight: 493.4172

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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=CC(=C(C=C3)Br)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CCC(=O)NC3=CC(=C(C=C3)Br)C

InChI

InChI=1S/C21H25BrN4O3S/c1-5-26-19-9-7-16(30(28,29)25(3)4)13-18(19)24-20(26)10-11-21(27)23-15-6-8-17(22)14(2)12-15/h6-9,12-13H,5,10-11H2,1-4H3,(H,23,27)