ethyl 3-[(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylmethyl]benzofuran-2-carboxylate CAS Name: 3-[[(1-ethyl-5-sulfamoyl-2-benzimidazolyl)thio]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(1-ethyl-5-sulfamoylbenzimidazol-2-yl)sulfanylmethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)thio]methyl]coumarilic acid ethyl ester Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=C(OC4=CC=CC=C43)C(=O)OCC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=C(OC4=CC=CC=C43)C(=O)OCC

InChI

InChI=1S/C21H21N3O5S2/c1-3-24-17-10-9-13(31(22,26)27)11-16(17)23-21(24)30-12-15-14-7-5-6-8-18(14)29-19(15)20(25)28-4-2/h5-11H,3-4,12H2,1-2H3,(H2,22,26,27)