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

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 4-ethoxybenzoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 4-ethoxybenzoate CAS Name: 4-ethoxybenzoic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 4-ethoxybenzoate Traditional Name: 4-ethoxybenzoic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O5S/c1-3-5-12-24-19-11-10-17(30(22,26)27)13-18(19)23-20(24)14-29-21(25)15-6-8-16(9-7-15)28-4-2/h6-11,13H,3-5,12,14H2,1-2H3,(H2,22,26,27)