2-[[2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-2-phenyl-ethanoyl]amino]-4,5-dimethoxy-benzoic acid

Systemtic Name: 2-[[2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-2-phenyl-ethanoyl]amino]-4,5-dimethoxy-benzoic acid Openeye Name: 2-[[2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-2-phenyl-acetyl]amino]-4,5-dimethoxy-benzoic acid CAS Name: 2-[[2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-1-oxo-2-phenylethyl]amino]-4,5-dimethoxybenzoic acid IUPAC Name: 2-[[2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-2-phenylacetyl]amino]-4,5-dimethoxybenzoic acid Traditional Name: 4,5-dimethoxy-2-[[2-phenyl-2-(piazthiol-4-ylsulfonylamino)acetyl]amino]benzoic acid Formula: C23H20N4O7S2 MolecularWeight: 528.5575

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)O)NC(=O)C(C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC4=NSN=C43)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)O)NC(=O)C(C2=CC=CC=C2)NS(=O)(=O)C3=CC=CC4=NSN=C43)OC

InChI

InChI=1S/C23H20N4O7S2/c1-33-17-11-14(23(29)30)16(12-18(17)34-2)24-22(28)20(13-7-4-3-5-8-13)27-36(31,32)19-10-6-9-15-21(19)26-35-25-15/h3-12,20,27H,1-2H3,(H,24,28)(H,29,30)