(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 2-(4-methylphenyl)ethanoate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 2-(4-methylphenyl)ethanoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 2-(p-tolyl)acetate CAS Name: 2-(4-methylphenyl)acetic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 2-(4-methylphenyl)acetate Traditional Name: 2-(p-tolyl)acetic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)CC3=CC=C(C=C3)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)CC3=CC=C(C=C3)C

InChI

InChI=1S/C21H25N3O4S/c1-3-4-11-24-19-10-9-17(29(22,26)27)13-18(19)23-20(24)14-28-21(25)12-16-7-5-15(2)6-8-16/h5-10,13H,3-4,11-12,14H2,1-2H3,(H2,22,26,27)