ethyl [5-methylsulfanyl-1-[[4-[2-(prop-2-enylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-2-propyl-imidazol-4-yl] carbonate

Systemtic Name: ethyl [5-methylsulfanyl-1-[[4-[2-(prop-2-enylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-2-propyl-imidazol-4-yl] carbonate Openeye Name: [1-[[4-[2-(allylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-5-methylsulfanyl-2-propyl-imidazol-4-yl] ethyl carbonate CAS Name: carbonic acid ethyl [5-(methylthio)-1-[[4-[2-[[oxo-(prop-2-enylamino)methyl]sulfamoyl]phenyl]phenyl]methyl]-2-propyl-4-imidazolyl] ester IUPAC Name: ethyl [5-methylsulfanyl-1-[[4-[2-(prop-2-enylcarbamoylsulfamoyl)phenyl]phenyl]methyl]-2-propylimidazol-4-yl] carbonate Traditional Name: carbonic acid [1-[4-[2-(allylcarbamoylsulfamoyl)phenyl]benzyl]-5-(methylthio)-2-propyl-imidazol-4-yl] ethyl ester Formula: C27H32N4O6S2 MolecularWeight: 572.69618

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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)NCC=C)SC)OC(=O)OCC

Isomeric SMILES

CCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)NCC=C)SC)OC(=O)OCC

InChI

InChI=1S/C27H32N4O6S2/c1-5-10-23-29-24(37-27(33)36-7-3)25(38-4)31(23)18-19-13-15-20(16-14-19)21-11-8-9-12-22(21)39(34,35)30-26(32)28-17-6-2/h6,8-9,11-16H,2,5,7,10,17-18H2,1,3-4H3,(H2,28,30,32)