ethyl 4-[[5-(diethylsulfamoyl)-1-(furan-2-ylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoate

Systemtic Name: ethyl 4-[[5-(diethylsulfamoyl)-1-(furan-2-ylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoate Openeye Name: ethyl 4-[[5-(diethylsulfamoyl)-1-(2-furylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoate CAS Name: 4-[[[5-(diethylsulfamoyl)-1-(2-furanylmethyl)-2-benzimidazolyl]thio]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[5-(diethylsulfamoyl)-1-(furan-2-ylmethyl)benzimidazol-2-yl]sulfanylmethyl]benzoate Traditional Name: 4-[[[5-(diethylsulfamoyl)-1-(2-furfuryl)benzimidazol-2-yl]thio]methyl]benzoic acid ethyl ester Formula: C26H29N3O5S2 MolecularWeight: 527.65556

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=C(C=C3)C(=O)OCC)CC4=CC=CO4

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N(C(=N2)SCC3=CC=C(C=C3)C(=O)OCC)CC4=CC=CO4

InChI

InChI=1S/C26H29N3O5S2/c1-4-28(5-2)36(31,32)22-13-14-24-23(16-22)27-26(29(24)17-21-8-7-15-34-21)35-18-19-9-11-20(12-10-19)25(30)33-6-3/h7-16H,4-6,17-18H2,1-3H3