4,5-dimethoxy-2-[[4-[methyl(phenyl)sulfamoyl]thiophen-2-yl]carbonylamino]benzoic acid

Systemtic Name: 4,5-dimethoxy-2-[[4-[methyl(phenyl)sulfamoyl]thiophen-2-yl]carbonylamino]benzoic acid Openeye Name: 4,5-dimethoxy-2-[[4-[methyl(phenyl)sulfamoyl]thiophene-2-carbonyl]amino]benzoic acid CAS Name: 4,5-dimethoxy-2-[[[4-[methyl(phenyl)sulfamoyl]-2-thiophenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4,5-dimethoxy-2-[[4-[methyl(phenyl)sulfamoyl]thiophene-2-carbonyl]amino]benzoic acid Traditional Name: 4,5-dimethoxy-2-[[4-[methyl(phenyl)sulfamoyl]thiophene-2-carbonyl]amino]benzoic acid Formula: C21H20N2O7S2 MolecularWeight: 476.5227

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)S(=O)(=O)C2=CSC(=C2)C(=O)NC3=CC(=C(C=C3C(=O)O)OC)OC

Isomeric SMILES

CN(C1=CC=CC=C1)S(=O)(=O)C2=CSC(=C2)C(=O)NC3=CC(=C(C=C3C(=O)O)OC)OC

InChI

InChI=1S/C21H20N2O7S2/c1-23(13-7-5-4-6-8-13)32(27,28)14-9-19(31-12-14)20(24)22-16-11-18(30-3)17(29-2)10-15(16)21(25)26/h4-12H,1-3H3,(H,22,24)(H,25,26)