methyl 4-[(2-phenylsulfanylphenyl)sulfamoylmethyl]benzoate

Systemtic Name: methyl 4-[(2-phenylsulfanylphenyl)sulfamoylmethyl]benzoate Openeye Name: methyl 4-[(2-phenylsulfanylphenyl)sulfamoylmethyl]benzoate CAS Name: 4-[[2-(phenylthio)phenyl]sulfamoylmethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-phenylsulfanylphenyl)sulfamoylmethyl]benzoate Traditional Name: 4-[[2-(phenylthio)phenyl]sulfamoylmethyl]benzoic acid methyl ester Formula: C21H19NO4S2 MolecularWeight: 413.50986

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)NC2=CC=CC=C2SC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CS(=O)(=O)NC2=CC=CC=C2SC3=CC=CC=C3

InChI

InChI=1S/C21H19NO4S2/c1-26-21(23)17-13-11-16(12-14-17)15-28(24,25)22-19-9-5-6-10-20(19)27-18-7-3-2-4-8-18/h2-14,22H,15H2,1H3