methyl 4-[2-(3,4-dimethylphenyl)sulfanylethylsulfamoyl]benzoate

Systemtic Name: methyl 4-[2-(3,4-dimethylphenyl)sulfanylethylsulfamoyl]benzoate Openeye Name: methyl 4-[2-(3,4-dimethylphenyl)sulfanylethylsulfamoyl]benzoate CAS Name: 4-[2-[(3,4-dimethylphenyl)thio]ethylsulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(3,4-dimethylphenyl)sulfanylethylsulfamoyl]benzoate Traditional Name: 4-[2-[(3,4-dimethylphenyl)thio]ethylsulfamoyl]benzoic acid methyl ester Formula: C18H21NO4S2 MolecularWeight: 379.49364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCNS(=O)(=O)C2=CC=C(C=C2)C(=O)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCNS(=O)(=O)C2=CC=C(C=C2)C(=O)OC)C

InChI

InChI=1S/C18H21NO4S2/c1-13-4-7-16(12-14(13)2)24-11-10-19-25(21,22)17-8-5-15(6-9-17)18(20)23-3/h4-9,12,19H,10-11H2,1-3H3