(2-morpholin-4-yl-2-oxidanylidene-ethyl) 4-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-ethyl) 4-[(5-bromanylthiophen-2-yl)sulfonylamino]benzoate Openeye Name: (2-morpholino-2-oxo-ethyl) 4-[(5-bromo-2-thienyl)sulfonylamino]benzoate CAS Name: 4-[(5-bromo-2-thiophenyl)sulfonylamino]benzoic acid [2-(4-morpholinyl)-2-oxoethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxoethyl) 4-[(5-bromothiophen-2-yl)sulfonylamino]benzoate Traditional Name: 4-[(5-bromo-2-thienyl)sulfonylamino]benzoic acid (2-keto-2-morpholino-ethyl) ester Formula: C17H17BrN2O6S2 MolecularWeight: 489.36068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)COC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1COCCN1C(=O)COC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C17H17BrN2O6S2/c18-14-5-6-16(27-14)28(23,24)19-13-3-1-12(2-4-13)17(22)26-11-15(21)20-7-9-25-10-8-20/h1-6,19H,7-11H2