2-[1-(dimethylsulfamoyl)-4-prop-2-enoxy-benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid

Systemtic Name: 2-[1-(dimethylsulfamoyl)-4-prop-2-enoxy-benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid Openeye Name: 2-[4-allyloxy-1-(dimethylsulfamoyl)benzimidazol-2-yl]-5-methyl-pyridine-3-carboxylic acid CAS Name: 2-[1-(dimethylsulfamoyl)-4-prop-2-enoxy-2-benzimidazolyl]-5-methyl-3-pyridinecarboxylic acid IUPAC Name: 2-[1-(dimethylsulfamoyl)-4-prop-2-enoxybenzimidazol-2-yl]-5-methylpyridine-3-carboxylic acid Traditional Name: 2-[4-allyloxy-1-(dimethylsulfamoyl)benzimidazol-2-yl]-5-methyl-nicotinic acid Formula: C19H20N4O5S MolecularWeight: 416.4509

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1)C(=O)O)C2=NC3=C(N2S(=O)(=O)N(C)C)C=CC=C3OCC=C

Isomeric SMILES

CC1=CN=C(C(=C1)C(=O)O)C2=NC3=C(N2S(=O)(=O)N(C)C)C=CC=C3OCC=C

InChI

InChI=1S/C19H20N4O5S/c1-5-9-28-15-8-6-7-14-17(15)21-18(23(14)29(26,27)22(3)4)16-13(19(24)25)10-12(2)11-20-16/h5-8,10-11H,1,9H2,2-4H3,(H,24,25)