methyl 5-[(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(1-ethyl-5-sulfamoyl-2-benzimidazolyl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(1-ethyl-5-sulfamoylbenzimidazol-2-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(1-ethyl-5-sulfamoyl-benzimidazol-2-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C16H17N3O5S2 MolecularWeight: 395.45328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC=C(O3)C(=O)OC

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SCC3=CC=C(O3)C(=O)OC

InChI

InChI=1S/C16H17N3O5S2/c1-3-19-13-6-5-11(26(17,21)22)8-12(13)18-16(19)25-9-10-4-7-14(24-10)15(20)23-2/h4-8H,3,9H2,1-2H3,(H2,17,21,22)