2-[1-(dimethylsulfamoyl)-4-ethoxy-benzimidazol-2-yl]-5-ethyl-pyridine-3-carboxylic acid

Systemtic Name: 2-[1-(dimethylsulfamoyl)-4-ethoxy-benzimidazol-2-yl]-5-ethyl-pyridine-3-carboxylic acid Openeye Name: 2-[1-(dimethylsulfamoyl)-4-ethoxy-benzimidazol-2-yl]-5-ethyl-pyridine-3-carboxylic acid CAS Name: 2-[1-(dimethylsulfamoyl)-4-ethoxy-2-benzimidazolyl]-5-ethyl-3-pyridinecarboxylic acid IUPAC Name: 2-[1-(dimethylsulfamoyl)-4-ethoxybenzimidazol-2-yl]-5-ethylpyridine-3-carboxylic acid Traditional Name: 2-[1-(dimethylsulfamoyl)-4-ethoxy-benzimidazol-2-yl]-5-ethyl-nicotinic acid Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C(=C1)C(=O)O)C2=NC3=C(N2S(=O)(=O)N(C)C)C=CC=C3OCC

Isomeric SMILES

CCC1=CN=C(C(=C1)C(=O)O)C2=NC3=C(N2S(=O)(=O)N(C)C)C=CC=C3OCC

InChI

InChI=1S/C19H22N4O5S/c1-5-12-10-13(19(24)25)16(20-11-12)18-21-17-14(8-7-9-15(17)28-6-2)23(18)29(26,27)22(3)4/h7-11H,5-6H2,1-4H3,(H,24,25)