(4-methylsulfanylphenyl)methyl 4-[methyl(phenyl)sulfamoyl]benzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 4-[methyl(phenyl)sulfamoyl]benzoate Openeye Name: (4-methylsulfanylphenyl)methyl 4-[methyl(phenyl)sulfamoyl]benzoate CAS Name: 4-[methyl(phenyl)sulfamoyl]benzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 4-[methyl(phenyl)sulfamoyl]benzoate Traditional Name: 4-[methyl(phenyl)sulfamoyl]benzoic acid [4-(methylthio)benzyl] ester Formula: C22H21NO4S2 MolecularWeight: 427.53644

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=C(C=C3)SC

Isomeric SMILES

CN(C1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=C(C=C3)SC

InChI

InChI=1S/C22H21NO4S2/c1-23(19-6-4-3-5-7-19)29(25,26)21-14-10-18(11-15-21)22(24)27-16-17-8-12-20(28-2)13-9-17/h3-15H,16H2,1-2H3