[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 2-(4-methylphenyl)ethanoate

Systemtic Name: [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 2-(4-methylphenyl)ethanoate Openeye Name: [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 2-(p-tolyl)acetate CAS Name: 2-(4-methylphenyl)acetic acid [5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]methyl 2-(4-methylphenyl)acetate Traditional Name: 2-(p-tolyl)acetic acid [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CC3=CC=C(C=C3)C

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)CC3=CC=C(C=C3)C

InChI

InChI=1S/C21H25N3O4S/c1-5-24-19-11-10-17(29(26,27)23(3)4)13-18(19)22-20(24)14-28-21(25)12-16-8-6-15(2)7-9-16/h6-11,13H,5,12,14H2,1-4H3