[1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoate

Systemtic Name: [1-oxidanylidene-1-[(3-sulfamoylphenyl)amino]propan-2-yl] 2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoate Openeye Name: [1-methyl-2-oxo-2-(3-sulfamoylanilino)ethyl] 2-(4-bromo-2-methyl-phenyl)sulfanylacetate CAS Name: 2-[(4-bromo-2-methylphenyl)thio]acetic acid [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(3-sulfamoylanilino)propan-2-yl] 2-(4-bromo-2-methylphenyl)sulfanylacetate Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]acetic acid [2-keto-1-methyl-2-(3-sulfamoylanilino)ethyl] ester Formula: C18H19BrN2O5S2 MolecularWeight: 487.38786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrN2O5S2/c1-11-8-13(19)6-7-16(11)27-10-17(22)26-12(2)18(23)21-14-4-3-5-15(9-14)28(20,24)25/h3-9,12H,10H2,1-2H3,(H,21,23)(H2,20,24,25)