ethyl 2-butyl-5-methylsulfanyl-3-[[4-[2-(2-phenylethanoylsulfamoyl)phenyl]phenyl]methyl]imidazole-4-carboxylate

Systemtic Name: ethyl 2-butyl-5-methylsulfanyl-3-[[4-[2-(2-phenylethanoylsulfamoyl)phenyl]phenyl]methyl]imidazole-4-carboxylate Openeye Name: ethyl 2-butyl-5-methylsulfanyl-3-[[4-[2-[(2-phenylacetyl)sulfamoyl]phenyl]phenyl]methyl]imidazole-4-carboxylate CAS Name: 2-butyl-5-(methylthio)-3-[[4-[2-[(1-oxo-2-phenylethyl)sulfamoyl]phenyl]phenyl]methyl]-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-5-methylsulfanyl-3-[[4-[2-[(2-phenylacetyl)sulfamoyl]phenyl]phenyl]methyl]imidazole-4-carboxylate Traditional Name: 2-butyl-5-(methylthio)-3-[4-[2-[(2-phenylacetyl)sulfamoyl]phenyl]benzyl]imidazole-4-carboxylic acid ethyl ester Formula: C32H35N3O5S2 MolecularWeight: 605.7674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)CC4=CC=CC=C4)C(=O)OCC)SC

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)CC4=CC=CC=C4)C(=O)OCC)SC

InChI

InChI=1S/C32H35N3O5S2/c1-4-6-16-28-33-31(41-3)30(32(37)40-5-2)35(28)22-24-17-19-25(20-18-24)26-14-10-11-15-27(26)42(38,39)34-29(36)21-23-12-8-7-9-13-23/h7-15,17-20H,4-6,16,21-22H2,1-3H3,(H,34,36)