methyl 4-[2-[(3-chlorophenyl)methylsulfanyl]ethylsulfamoylmethyl]benzoate

Systemtic Name: methyl 4-[2-[(3-chlorophenyl)methylsulfanyl]ethylsulfamoylmethyl]benzoate Openeye Name: methyl 4-[2-[(3-chlorophenyl)methylsulfanyl]ethylsulfamoylmethyl]benzoate CAS Name: 4-[2-[(3-chlorophenyl)methylthio]ethylsulfamoylmethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(3-chlorophenyl)methylsulfanyl]ethylsulfamoylmethyl]benzoate Traditional Name: 4-[2-[(3-chlorobenzyl)thio]ethylsulfamoylmethyl]benzoic acid methyl ester Formula: C18H20ClNO4S2 MolecularWeight: 413.9387

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)NCCSCC2=CC(=CC=C2)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)NCCSCC2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H20ClNO4S2/c1-24-18(21)16-7-5-14(6-8-16)13-26(22,23)20-9-10-25-12-15-3-2-4-17(19)11-15/h2-8,11,20H,9-10,12-13H2,1H3