(4-methylsulfanylphenyl)methyl 4-chloranyl-3-(diethylsulfamoyl)benzoate

Systemtic Name: (4-methylsulfanylphenyl)methyl 4-chloranyl-3-(diethylsulfamoyl)benzoate Openeye Name: (4-methylsulfanylphenyl)methyl 4-chloro-3-(diethylsulfamoyl)benzoate CAS Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid [4-(methylthio)phenyl]methyl ester IUPAC Name: (4-methylsulfanylphenyl)methyl 4-chloro-3-(diethylsulfamoyl)benzoate Traditional Name: 4-chloro-3-(diethylsulfamoyl)benzoic acid [4-(methylthio)benzyl] ester Formula: C19H22ClNO4S2 MolecularWeight: 427.96528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22ClNO4S2/c1-4-21(5-2)27(23,24)18-12-15(8-11-17(18)20)19(22)25-13-14-6-9-16(26-3)10-7-14/h6-12H,4-5,13H2,1-3H3