ethyl 2-butyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-5-[2,2,2-tris(fluoranyl)ethylsulfanyl]imidazole-4-carboxylate

Systemtic Name: ethyl 2-butyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-5-[2,2,2-tris(fluoranyl)ethylsulfanyl]imidazole-4-carboxylate Openeye Name: ethyl 2-butyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-5-(2,2,2-trifluoroethylsulfanyl)imidazole-4-carboxylate CAS Name: 2-butyl-3-[[4-[2-[[oxo(propylamino)methyl]sulfamoyl]phenyl]phenyl]methyl]-5-(2,2,2-trifluoroethylthio)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-butyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-5-(2,2,2-trifluoroethylsulfanyl)imidazole-4-carboxylate Traditional Name: 2-butyl-3-[4-[2-(propylcarbamoylsulfamoyl)phenyl]benzyl]-5-(2,2,2-trifluoroethylthio)imidazole-4-carboxylic acid ethyl ester Formula: C29H35F3N4O5S2 MolecularWeight: 640.73721

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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)NCCC)C(=O)OCC)SCC(F)(F)F

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)NCCC)C(=O)OCC)SCC(F)(F)F

InChI

InChI=1S/C29H35F3N4O5S2/c1-4-7-12-24-34-26(42-19-29(30,31)32)25(27(37)41-6-3)36(24)18-20-13-15-21(16-14-20)22-10-8-9-11-23(22)43(39,40)35-28(38)33-17-5-2/h8-11,13-16H,4-7,12,17-19H2,1-3H3,(H2,33,35,38)