[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl] 2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl] 2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoate Openeye Name: [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-(4-bromo-2-methyl-phenyl)sulfanylacetate CAS Name: 2-[(4-bromo-2-methylphenyl)thio]acetic acid [2-oxo-2-(4-sulfamoylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-sulfamoylanilino)ethyl] 2-(4-bromo-2-methylphenyl)sulfanylacetate Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]acetic acid [2-keto-2-(4-sulfamoylanilino)ethyl] ester Formula: C17H17BrN2O5S2 MolecularWeight: 473.36128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C17H17BrN2O5S2/c1-11-8-12(18)2-7-15(11)26-10-17(22)25-9-16(21)20-13-3-5-14(6-4-13)27(19,23)24/h2-8H,9-10H2,1H3,(H,20,21)(H2,19,23,24)