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

Systemtic Name: methyl 5-[[5-(diethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[[5-(diethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[5-(diethylsulfamoyl)-1-ethyl-2-benzimidazolyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[5-(diethylsulfamoyl)-1-ethylbenzimidazol-2-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[5-(diethylsulfamoyl)-1-ethyl-benzimidazol-2-yl]thio]methyl]furan-2-carboxylic acid methyl ester Formula: C20H25N3O5S2 MolecularWeight: 451.5596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O5S2/c1-5-22(6-2)30(25,26)15-9-10-17-16(12-15)21-20(23(17)7-3)29-13-14-8-11-18(28-14)19(24)27-4/h8-12H,5-7,13H2,1-4H3