ethyl 4-[[3-[(5-bromanylthiophen-2-yl)sulfonylamino]quinoxalin-2-yl]amino]benzoate

Systemtic Name: ethyl 4-[[3-[(5-bromanylthiophen-2-yl)sulfonylamino]quinoxalin-2-yl]amino]benzoate Openeye Name: ethyl 4-[[3-[(5-bromo-2-thienyl)sulfonylamino]quinoxalin-2-yl]amino]benzoate CAS Name: 4-[[3-[(5-bromo-2-thiophenyl)sulfonylamino]-2-quinoxalinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-[(5-bromothiophen-2-yl)sulfonylamino]quinoxalin-2-yl]amino]benzoate Traditional Name: 4-[[3-[(5-bromo-2-thienyl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid ethyl ester Formula: C21H17BrN4O4S2 MolecularWeight: 533.41808

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(S4)Br

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC3=CC=CC=C3N=C2NS(=O)(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C21H17BrN4O4S2/c1-2-30-21(27)13-7-9-14(10-8-13)23-19-20(25-16-6-4-3-5-15(16)24-19)26-32(28,29)18-12-11-17(22)31-18/h3-12H,2H2,1H3,(H,23,24)(H,25,26)