3-[[4-[2-(ethylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-5-methylsulfonyl-2-propyl-imidazole-4-carboxylic acid

Systemtic Name: 3-[[4-[2-(ethylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-5-methylsulfonyl-2-propyl-imidazole-4-carboxylic acid Openeye Name: 3-[[4-[2-(ethylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-5-methylsulfonyl-2-propyl-imidazole-4-carboxylic acid CAS Name: 3-[[4-[2-(ethylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-5-methylsulfonyl-2-propyl-4-imidazolecarboxylic acid IUPAC Name: 3-[[4-[2-(ethylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-5-methylsulfonyl-2-propylimidazole-4-carboxylic acid Traditional Name: 3-[4-[2-(ethylcarbamoylsulfamoyl)phenyl]benzyl]-5-mesyl-2-propyl-imidazole-4-carboxylic acid Formula: C24H28N4O7S2 MolecularWeight: 548.63172

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)NCC)C(=O)O)S(=O)(=O)C

Isomeric SMILES

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)NCC)C(=O)O)S(=O)(=O)C

InChI

InChI=1S/C24H28N4O7S2/c1-4-8-20-26-22(36(3,32)33)21(23(29)30)28(20)15-16-11-13-17(14-12-16)18-9-6-7-10-19(18)37(34,35)27-24(31)25-5-2/h6-7,9-14H,4-5,8,15H2,1-3H3,(H,29,30)(H2,25,27,31)