2-butyl-N-methyl-5-methylsulfanyl-3-[[4-(2-sulfamoylphenyl)phenyl]methyl]imidazole-4-carboxamide

Systemtic Name: 2-butyl-N-methyl-5-methylsulfanyl-3-[[4-(2-sulfamoylphenyl)phenyl]methyl]imidazole-4-carboxamide Openeye Name: 2-butyl-N-methyl-5-methylsulfanyl-3-[[4-(2-sulfamoylphenyl)phenyl]methyl]imidazole-4-carboxamide CAS Name: 2-butyl-N-methyl-5-(methylthio)-3-[[4-(2-sulfamoylphenyl)phenyl]methyl]-4-imidazolecarboxamide IUPAC Name: 2-butyl-N-methyl-5-methylsulfanyl-3-[[4-(2-sulfamoylphenyl)phenyl]methyl]imidazole-4-carboxamide Traditional Name: 2-butyl-N-methyl-5-(methylthio)-3-[4-(2-sulfamoylphenyl)benzyl]imidazole-4-carboxamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)C(=O)NC)SC

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)C(=O)NC)SC

InChI

InChI=1S/C23H28N4O3S2/c1-4-5-10-20-26-23(31-3)21(22(28)25-2)27(20)15-16-11-13-17(14-12-16)18-8-6-7-9-19(18)32(24,29)30/h6-9,11-14H,4-5,10,15H2,1-3H3,(H,25,28)(H2,24,29,30)