1-[4-(2-sulfamoylphenyl)phenyl]pentan-3-yl 2-(4-methylsulfanyl-1H-imidazol-5-yl)-2-oxidanyl-propanoate

Systemtic Name: 1-[4-(2-sulfamoylphenyl)phenyl]pentan-3-yl 2-(4-methylsulfanyl-1H-imidazol-5-yl)-2-oxidanyl-propanoate Openeye Name: [1-ethyl-3-[4-(2-sulfamoylphenyl)phenyl]propyl] 2-hydroxy-2-(4-methylsulfanyl-1H-imidazol-5-yl)propanoate CAS Name: 2-hydroxy-2-[4-(methylthio)-1H-imidazol-5-yl]propanoic acid 1-[4-(2-sulfamoylphenyl)phenyl]pentan-3-yl ester IUPAC Name: 1-[4-(2-sulfamoylphenyl)phenyl]pentan-3-yl 2-hydroxy-2-(4-methylsulfanyl-1H-imidazol-5-yl)propanoate Traditional Name: 2-hydroxy-2-[4-(methylthio)-1H-imidazol-5-yl]propionic acid [1-ethyl-3-[4-(2-sulfamoylphenyl)phenyl]propyl] ester Formula: C24H29N3O5S2 MolecularWeight: 503.63416

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)N)OC(=O)C(C)(C3=C(N=CN3)SC)O

Isomeric SMILES

CCC(CCC1=CC=C(C=C1)C2=CC=CC=C2S(=O)(=O)N)OC(=O)C(C)(C3=C(N=CN3)SC)O

InChI

InChI=1S/C24H29N3O5S2/c1-4-18(32-23(28)24(2,29)21-22(33-3)27-15-26-21)14-11-16-9-12-17(13-10-16)19-7-5-6-8-20(19)34(25,30)31/h5-10,12-13,15,18,29H,4,11,14H2,1-3H3,(H,26,27)(H2,25,30,31)