2-[2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl]sulfanyl-N,N-diethyl-1,3-benzoxazole-5-sulfonamide

Systemtic Name: 2-[2-(1-benzofuran-2-yl)-2-oxidanylidene-ethyl]sulfanyl-N,N-diethyl-1,3-benzoxazole-5-sulfonamide Openeye Name: 2-[2-(benzofuran-2-yl)-2-oxo-ethyl]sulfanyl-N,N-diethyl-1,3-benzoxazole-5-sulfonamide CAS Name: 2-[[2-(2-benzofuranyl)-2-oxoethyl]thio]-N,N-diethyl-1,3-benzoxazole-5-sulfonamide IUPAC Name: 2-[2-(1-benzofuran-2-yl)-2-oxoethyl]sulfanyl-N,N-diethyl-1,3-benzoxazole-5-sulfonamide Traditional Name: 2-[[2-(benzofuran-2-yl)-2-keto-ethyl]thio]-N,N-diethyl-1,3-benzoxazole-5-sulfonamide Formula: C21H20N2O5S2 MolecularWeight: 444.5239

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)OC(=N2)SCC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H20N2O5S2/c1-3-23(4-2)30(25,26)15-9-10-19-16(12-15)22-21(28-19)29-13-17(24)20-11-14-7-5-6-8-18(14)27-20/h5-12H,3-4,13H2,1-2H3