methyl 5-bromanyl-2-[[2-(butan-2-ylcarbamoyl)phenyl]sulfamoyl]benzoate

Systemtic Name: methyl 5-bromanyl-2-[[2-(butan-2-ylcarbamoyl)phenyl]sulfamoyl]benzoate Openeye Name: methyl 5-bromo-2-[[2-(sec-butylcarbamoyl)phenyl]sulfamoyl]benzoate CAS Name: 5-bromo-2-[[2-[(butan-2-ylamino)-oxomethyl]phenyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 5-bromo-2-[[2-(butan-2-ylcarbamoyl)phenyl]sulfamoyl]benzoate Traditional Name: 5-bromo-2-[[2-(sec-butylcarbamoyl)phenyl]sulfamoyl]benzoic acid methyl ester Formula: C19H21BrN2O5S MolecularWeight: 469.34944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NS(=O)(=O)C2=C(C=C(C=C2)Br)C(=O)OC

Isomeric SMILES

CCC(C)NC(=O)C1=CC=CC=C1NS(=O)(=O)C2=C(C=C(C=C2)Br)C(=O)OC

InChI

InChI=1S/C19H21BrN2O5S/c1-4-12(2)21-18(23)14-7-5-6-8-16(14)22-28(25,26)17-10-9-13(20)11-15(17)19(24)27-3/h5-12,22H,4H2,1-3H3,(H,21,23)