2-[[3-[(4-bromanyl-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophen-2-yl]carbonylamino]benzoic acid

Systemtic Name: 2-[[3-[(4-bromanyl-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophen-2-yl]carbonylamino]benzoic acid Openeye Name: 2-[[3-[(4-bromo-3-methyl-isoxazol-5-yl)sulfamoyl]thiophene-2-carbonyl]amino]benzoic acid CAS Name: 2-[[[3-[(4-bromo-3-methyl-5-isoxazolyl)sulfamoyl]-2-thiophenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[3-[(4-bromo-3-methyl-1,2-oxazol-5-yl)sulfamoyl]thiophene-2-carbonyl]amino]benzoic acid Traditional Name: 2-[[3-[(4-bromo-3-methyl-isoxazol-5-yl)sulfamoyl]thiophene-2-carbonyl]amino]benzoic acid Formula: C16H12BrN3O6S2 MolecularWeight: 486.31698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1Br)NS(=O)(=O)C2=C(SC=C2)C(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1=NOC(=C1Br)NS(=O)(=O)C2=C(SC=C2)C(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C16H12BrN3O6S2/c1-8-12(17)15(26-19-8)20-28(24,25)11-6-7-27-13(11)14(21)18-10-5-3-2-4-9(10)16(22)23/h2-7,20H,1H3,(H,18,21)(H,22,23)