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

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoate Openeye Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-(4-bromo-2-methyl-phenyl)sulfanylacetate CAS Name: 2-[(4-bromo-2-methylphenyl)thio]acetic acid [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] 2-(4-bromo-2-methylphenyl)sulfanylacetate Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]acetic acid [2-keto-2-[(4-sulfamoylbenzyl)amino]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)OCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)OCC(=O)NCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C18H19BrN2O5S2/c1-12-8-14(19)4-7-16(12)27-11-18(23)26-10-17(22)21-9-13-2-5-15(6-3-13)28(20,24)25/h2-8H,9-11H2,1H3,(H,21,22)(H2,20,24,25)