(4-methylsulfanylphenyl)methyl 2-chloranyl-5-(dimethylsulfamoyl)benzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 2-chloranyl-5-(dimethylsulfamoyl)benzoate Openeye Name: (4-methylsulfanylphenyl)methyl 2-chloro-5-(dimethylsulfamoyl)benzoate CAS Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 2-chloro-5-(dimethylsulfamoyl)benzoate Traditional Name: 2-chloro-5-(dimethylsulfamoyl)benzoic acid [4-(methylthio)benzyl] ester Formula: C17H18ClNO4S2 MolecularWeight: 399.91212

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC2=CC=C(C=C2)SC

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC2=CC=C(C=C2)SC

InChI

InChI=1S/C17H18ClNO4S2/c1-19(2)25(21,22)14-8-9-16(18)15(10-14)17(20)23-11-12-4-6-13(24-3)7-5-12/h4-10H,11H2,1-3H3