ethyl 2-cyclopropyl-5-methylsulfanyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]imidazole-4-carboxylate

Systemtic Name: ethyl 2-cyclopropyl-5-methylsulfanyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]imidazole-4-carboxylate Openeye Name: ethyl 2-cyclopropyl-5-methylsulfanyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]imidazole-4-carboxylate CAS Name: 2-cyclopropyl-5-(methylthio)-3-[[4-[2-[[oxo(propylamino)methyl]sulfamoyl]phenyl]phenyl]methyl]-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-cyclopropyl-5-methylsulfanyl-3-[[4-[2-(propylcarbamoylsulfamoyl)phenyl]phenyl]methyl]imidazole-4-carboxylate Traditional Name: 2-cyclopropyl-5-(methylthio)-3-[4-[2-(propylcarbamoylsulfamoyl)phenyl]benzyl]imidazole-4-carboxylic acid ethyl ester Formula: C27H32N4O5S2 MolecularWeight: 556.69678

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)CN3C(=NC(=C3C(=O)OCC)SC)C4CC4

Isomeric SMILES

CCCNC(=O)NS(=O)(=O)C1=CC=CC=C1C2=CC=C(C=C2)CN3C(=NC(=C3C(=O)OCC)SC)C4CC4

InChI

InChI=1S/C27H32N4O5S2/c1-4-16-28-27(33)30-38(34,35)22-9-7-6-8-21(22)19-12-10-18(11-13-19)17-31-23(26(32)36-5-2)25(37-3)29-24(31)20-14-15-20/h6-13,20H,4-5,14-17H2,1-3H3,(H2,28,30,33)