ethyl 3-methyl-5-[[2-(propanoylamino)-1,3-benzothiazol-6-yl]sulfamoyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-[[2-(propanoylamino)-1,3-benzothiazol-6-yl]sulfamoyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-methyl-5-[[2-(propanoylamino)-1,3-benzothiazol-6-yl]sulfamoyl]benzofuran-2-carboxylate CAS Name: 3-methyl-5-[[2-(1-oxopropylamino)-1,3-benzothiazol-6-yl]sulfamoyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[[2-(propanoylamino)-1,3-benzothiazol-6-yl]sulfamoyl]-1-benzofuran-2-carboxylate Traditional Name: 3-methyl-5-[(2-propionamido-1,3-benzothiazol-6-yl)sulfamoyl]coumarilic acid ethyl ester Formula: C22H21N3O6S2 MolecularWeight: 487.54864

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC2=C(S1)C=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OC(=C4C)C(=O)OCC

Isomeric SMILES

CCC(=O)NC1=NC2=C(S1)C=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OC(=C4C)C(=O)OCC

InChI

InChI=1S/C22H21N3O6S2/c1-4-19(26)24-22-23-16-8-6-13(10-18(16)32-22)25-33(28,29)14-7-9-17-15(11-14)12(3)20(31-17)21(27)30-5-2/h6-11,25H,4-5H2,1-3H3,(H,23,24,26)