[2-(tert-butylamino)-2-oxidanylidene-ethyl] 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 2-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 2-[(5-bromo-2-thienyl)sulfonylamino]benzoate CAS Name: 2-[(5-bromo-2-thiophenyl)sulfonylamino]benzoic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 2-[(5-bromothiophen-2-yl)sulfonylamino]benzoate Traditional Name: 2-[(5-bromo-2-thienyl)sulfonylamino]benzoic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C17H19BrN2O5S2 MolecularWeight: 475.37716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19BrN2O5S2/c1-17(2,3)19-14(21)10-25-16(22)11-6-4-5-7-12(11)20-27(23,24)15-9-8-13(18)26-15/h4-9,20H,10H2,1-3H3,(H,19,21)