2-[1-(dimethylsulfamoyl)-4-ethoxy-benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylic acid

Systemtic Name: 2-[1-(dimethylsulfamoyl)-4-ethoxy-benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylic acid Openeye Name: 2-[1-(dimethylsulfamoyl)-4-ethoxy-benzimidazol-2-yl]-6-methyl-pyridine-3-carboxylic acid CAS Name: 2-[1-(dimethylsulfamoyl)-4-ethoxy-2-benzimidazolyl]-6-methyl-3-pyridinecarboxylic acid IUPAC Name: 2-[1-(dimethylsulfamoyl)-4-ethoxybenzimidazol-2-yl]-6-methylpyridine-3-carboxylic acid Traditional Name: 2-[1-(dimethylsulfamoyl)-4-ethoxy-benzimidazol-2-yl]-6-methyl-nicotinic acid Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1N=C(N2S(=O)(=O)N(C)C)C3=C(C=CC(=N3)C)C(=O)O

Isomeric SMILES

CCOC1=CC=CC2=C1N=C(N2S(=O)(=O)N(C)C)C3=C(C=CC(=N3)C)C(=O)O

InChI

InChI=1S/C18H20N4O5S/c1-5-27-14-8-6-7-13-16(14)20-17(22(13)28(25,26)21(3)4)15-12(18(23)24)10-9-11(2)19-15/h6-10H,5H2,1-4H3,(H,23,24)