[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]sulfamoyl]benzoate

Systemtic Name: [2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 3-[[4-[bis(fluoranyl)methylsulfanyl]phenyl]sulfamoyl]benzoate Openeye Name: [2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl] 3-[[4-(difluoromethylsulfanyl)phenyl]sulfamoyl]benzoate CAS Name: 3-[[4-(difluoromethylthio)phenyl]sulfamoyl]benzoic acid [2-(2-bromo-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-bromo-4-methylanilino)-2-oxoethyl] 3-[[4-(difluoromethylsulfanyl)phenyl]sulfamoyl]benzoate Traditional Name: 3-[[4-(difluoromethylthio)phenyl]sulfamoyl]benzoic acid [2-(2-bromo-4-methyl-anilino)-2-keto-ethyl] ester Formula: C23H19BrF2N2O5S2 MolecularWeight: 585.438166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)SC(F)F)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)S(=O)(=O)NC3=CC=C(C=C3)SC(F)F)Br

InChI

InChI=1S/C23H19BrF2N2O5S2/c1-14-5-10-20(19(24)11-14)27-21(29)13-33-22(30)15-3-2-4-18(12-15)35(31,32)28-16-6-8-17(9-7-16)34-23(25)26/h2-12,23,28H,13H2,1H3,(H,27,29)