(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl pyridine-2-carboxylate

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl pyridine-2-carboxylate Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl pyridine-2-carboxylate CAS Name: 2-pyridinecarboxylic acid (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl ester IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl pyridine-2-carboxylate Traditional Name: picolinic acid (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl ester Formula: C18H20N4O4S MolecularWeight: 388.4408

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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=N3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1COC(=O)C3=CC=CC=N3

InChI

InChI=1S/C18H20N4O4S/c1-2-3-10-22-16-8-7-13(27(19,24)25)11-15(16)21-17(22)12-26-18(23)14-6-4-5-9-20-14/h4-9,11H,2-3,10,12H2,1H3,(H2,19,24,25)