2-butyl-3-[[3-(tert-butylsulfamoyl)-4-phenyl-phenyl]methyl]-5-chloranyl-imidazole-4-carboxylic acid

Systemtic Name: 2-butyl-3-[[3-(tert-butylsulfamoyl)-4-phenyl-phenyl]methyl]-5-chloranyl-imidazole-4-carboxylic acid Openeye Name: 2-butyl-3-[[3-(tert-butylsulfamoyl)-4-phenyl-phenyl]methyl]-5-chloro-imidazole-4-carboxylic acid CAS Name: 2-butyl-3-[[3-(tert-butylsulfamoyl)-4-phenylphenyl]methyl]-5-chloro-4-imidazolecarboxylic acid IUPAC Name: 2-butyl-3-[[3-(tert-butylsulfamoyl)-4-phenylphenyl]methyl]-5-chloroimidazole-4-carboxylic acid Traditional Name: 2-butyl-3-[3-(tert-butylsulfamoyl)-4-phenyl-benzyl]-5-chloro-imidazole-4-carboxylic acid Formula: C25H30ClN3O4S MolecularWeight: 504.0414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC(=C(C=C2)C3=CC=CC=C3)S(=O)(=O)NC(C)(C)C)C(=O)O)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC(=C(C=C2)C3=CC=CC=C3)S(=O)(=O)NC(C)(C)C)C(=O)O)Cl

InChI

InChI=1S/C25H30ClN3O4S/c1-5-6-12-21-27-23(26)22(24(30)31)29(21)16-17-13-14-19(18-10-8-7-9-11-18)20(15-17)34(32,33)28-25(2,3)4/h7-11,13-15,28H,5-6,12,16H2,1-4H3,(H,30,31)