3-[5-[2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-oxadiazol-2-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 3-[5-[2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-oxadiazol-2-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 3-[5-[2-(benzofuran-2-yl)-2-oxo-ethyl]sulfanyl-1,3,4-oxadiazol-2-yl]-N,N-diethyl-benzenesulfonamide CAS Name: 3-[5-[[2-(2-benzofuranyl)-2-oxoethyl]thio]-1,3,4-oxadiazol-2-yl]-N,N-diethylbenzenesulfonamide IUPAC Name: 3-[5-[2-(1-benzofuran-2-yl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]-N,N-diethylbenzenesulfonamide Traditional Name: 3-[5-[[2-(benzofuran-2-yl)-2-keto-ethyl]thio]-1,3,4-oxadiazol-2-yl]-N,N-diethyl-benzenesulfonamide Formula: C22H21N3O5S2 MolecularWeight: 471.54924

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(O2)SCC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C2=NN=C(O2)SCC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C22H21N3O5S2/c1-3-25(4-2)32(27,28)17-10-7-9-16(12-17)21-23-24-22(30-21)31-14-18(26)20-13-15-8-5-6-11-19(15)29-20/h5-13H,3-4,14H2,1-2H3