[5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 2-(2-hydroxyethylamino)benzoate

Systemtic Name: [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 2-(2-hydroxyethylamino)benzoate Openeye Name: [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl 2-(2-hydroxyethylamino)benzoate CAS Name: 2-(2-hydroxyethylamino)benzoic acid [5-(dimethylsulfamoyl)-1-ethyl-2-benzimidazolyl]methyl ester IUPAC Name: [5-(dimethylsulfamoyl)-1-ethylbenzimidazol-2-yl]methyl 2-(2-hydroxyethylamino)benzoate Traditional Name: 2-(2-hydroxyethylamino)benzoic acid [5-(dimethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]methyl ester Formula: C21H26N4O5S MolecularWeight: 446.51994

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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)C3=CC=CC=C3NCCO

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1COC(=O)C3=CC=CC=C3NCCO

InChI

InChI=1S/C21H26N4O5S/c1-4-25-19-10-9-15(31(28,29)24(2)3)13-18(19)23-20(25)14-30-21(27)16-7-5-6-8-17(16)22-11-12-26/h5-10,13,22,26H,4,11-12,14H2,1-3H3