[2-cyclopropyl-5-methylsulfanyl-3-[[2-(4-sulfamoylphenyl)phenyl]methyl]imidazol-4-yl] ethyl carbonate

Systemtic Name: [2-cyclopropyl-5-methylsulfanyl-3-[[2-(4-sulfamoylphenyl)phenyl]methyl]imidazol-4-yl] ethyl carbonate Openeye Name: [2-cyclopropyl-5-methylsulfanyl-3-[[2-(4-sulfamoylphenyl)phenyl]methyl]imidazol-4-yl] ethyl carbonate CAS Name: carbonic acid [2-cyclopropyl-5-(methylthio)-3-[[2-(4-sulfamoylphenyl)phenyl]methyl]-4-imidazolyl] ethyl ester IUPAC Name: [2-cyclopropyl-5-methylsulfanyl-3-[[2-(4-sulfamoylphenyl)phenyl]methyl]imidazol-4-yl] ethyl carbonate Traditional Name: carbonic acid [2-cyclopropyl-5-(methylthio)-3-[2-(4-sulfamoylphenyl)benzyl]imidazol-4-yl] ethyl ester Formula: C23H25N3O5S2 MolecularWeight: 487.5917

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC1=C(N=C(N1CC2=CC=CC=C2C3=CC=C(C=C3)S(=O)(=O)N)C4CC4)SC

Isomeric SMILES

CCOC(=O)OC1=C(N=C(N1CC2=CC=CC=C2C3=CC=C(C=C3)S(=O)(=O)N)C4CC4)SC

InChI

InChI=1S/C23H25N3O5S2/c1-3-30-23(27)31-22-21(32-2)25-20(16-8-9-16)26(22)14-17-6-4-5-7-19(17)15-10-12-18(13-11-15)33(24,28)29/h4-7,10-13,16H,3,8-9,14H2,1-2H3,(H2,24,28,29)