5-methylsulfanyl-3-[[4-[2-(propoxycarbonylsulfamoyl)phenyl]phenyl]methyl]-2-propyl-imidazole-4-carboxylate

Systemtic Name: 5-methylsulfanyl-3-[[4-[2-(propoxycarbonylsulfamoyl)phenyl]phenyl]methyl]-2-propyl-imidazole-4-carboxylate Openeye Name: 5-methylsulfanyl-3-[[4-[2-(propoxycarbonylsulfamoyl)phenyl]phenyl]methyl]-2-propyl-imidazole-4-carboxylate CAS Name: 5-(methylthio)-3-[[4-[2-[[oxo(propoxy)methyl]sulfamoyl]phenyl]phenyl]methyl]-2-propyl-4-imidazolecarboxylate IUPAC Name: 5-methylsulfanyl-3-[[4-[2-(propoxycarbonylsulfamoyl)phenyl]phenyl]methyl]-2-propylimidazole-4-carboxylate Traditional Name: 5-(methylthio)-3-[4-[2-(propoxycarbonylsulfamoyl)phenyl]benzyl]-2-propyl-imidazole-4-carboxylate Formula: C25H28N3O6S2- MolecularWeight: 530.63632

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)OCCC)C(=O)[O-])SC

Isomeric SMILES

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)OCCC)C(=O)[O-])SC

InChI

InChI=1S/C25H29N3O6S2/c1-4-8-21-26-23(35-3)22(24(29)30)28(21)16-17-11-13-18(14-12-17)19-9-6-7-10-20(19)36(32,33)27-25(31)34-15-5-2/h6-7,9-14H,4-5,8,15-16H2,1-3H3,(H,27,31)(H,29,30)/p-1