4-[[3-[(5-bromanylthiophen-2-yl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid

Systemtic Name: 4-[[3-[(5-bromanylthiophen-2-yl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid Openeye Name: 4-[[3-[(5-bromo-2-thienyl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid CAS Name: 4-[[3-[(5-bromo-2-thiophenyl)sulfonylamino]-2-quinoxalinyl]amino]benzoic acid IUPAC Name: 4-[[3-[(5-bromothiophen-2-yl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid Traditional Name: 4-[[3-[(5-bromo-2-thienyl)sulfonylamino]quinoxalin-2-yl]amino]benzoic acid Formula: C19H13BrN4O4S2 MolecularWeight: 505.36492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC=C(S3)Br)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(C(=N2)NS(=O)(=O)C3=CC=C(S3)Br)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C19H13BrN4O4S2/c20-15-9-10-16(29-15)30(27,28)24-18-17(22-13-3-1-2-4-14(13)23-18)21-12-7-5-11(6-8-12)19(25)26/h1-10H,(H,21,22)(H,23,24)(H,25,26)