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

Systemtic Name: ethyl 5-[(3-ethyl-2-oxidanylidene-1,3-benzothiazol-6-yl)sulfamoyl]-3-methyl-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-[(3-ethyl-2-oxo-1,3-benzothiazol-6-yl)sulfamoyl]-3-methyl-benzofuran-2-carboxylate CAS Name: 5-[(3-ethyl-2-oxo-1,3-benzothiazol-6-yl)sulfamoyl]-3-methyl-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-ethyl-2-oxo-1,3-benzothiazol-6-yl)sulfamoyl]-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-[(3-ethyl-2-keto-1,3-benzothiazol-6-yl)sulfamoyl]-3-methyl-coumarilic acid ethyl ester Formula: C21H20N2O6S2 MolecularWeight: 460.5233

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OC(=C4C)C(=O)OCC)SC1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OC(=C4C)C(=O)OCC)SC1=O

InChI

InChI=1S/C21H20N2O6S2/c1-4-23-16-8-6-13(10-18(16)30-21(23)25)22-31(26,27)14-7-9-17-15(11-14)12(3)19(29-17)20(24)28-5-2/h6-11,22H,4-5H2,1-3H3