(3,3-dimethyl-2-oxidanylidene-butyl) 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[(5-bromo-2-thienyl)sulfonylamino]benzoate CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonylamino]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[(5-bromothiophen-2-yl)sulfonylamino]benzoate Traditional Name: 2-[(5-bromo-2-thienyl)sulfonylamino]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C17H18BrNO5S2 MolecularWeight: 460.36252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(S2)Br

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C17H18BrNO5S2/c1-17(2,3)13(20)10-24-16(21)11-6-4-5-7-12(11)19-26(22,23)15-9-8-14(18)25-15/h4-9,19H,10H2,1-3H3