(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 3-(ethoxycarbonylamino)benzoate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 3-(ethoxycarbonylamino)benzoate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl 3-(ethoxycarbonylamino)benzoate CAS Name: 3-(ethoxycarbonylamino)benzoic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl 3-(ethoxycarbonylamino)benzoate Traditional Name: 3-(carbethoxyamino)benzoic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C22H26N4O6S MolecularWeight: 474.53004

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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(=CC=C3)NC(=O)OCC

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O6S/c1-3-5-11-26-19-10-9-17(33(23,29)30)13-18(19)25-20(26)14-32-21(27)15-7-6-8-16(12-15)24-22(28)31-4-2/h6-10,12-13H,3-5,11,14H2,1-2H3,(H,24,28)(H2,23,29,30)