2-(1-benzofuran-2-yl)-1-[4-(dimethoxymethyl)-2-pyrrolidin-2-ylcarbonyl-5-sulfanylidene-1,3-thiazolidin-3-yl]ethanone

Systemtic Name: 2-(1-benzofuran-2-yl)-1-[4-(dimethoxymethyl)-2-pyrrolidin-2-ylcarbonyl-5-sulfanylidene-1,3-thiazolidin-3-yl]ethanone Openeye Name: 2-(benzofuran-2-yl)-1-[4-(dimethoxymethyl)-2-(pyrrolidine-2-carbonyl)-5-thioxo-thiazolidin-3-yl]ethanone CAS Name: 2-(2-benzofuranyl)-1-[4-(dimethoxymethyl)-2-[oxo(2-pyrrolidinyl)methyl]-5-sulfanylidene-3-thiazolidinyl]ethanone IUPAC Name: 2-(1-benzofuran-2-yl)-1-[4-(dimethoxymethyl)-2-(pyrrolidine-2-carbonyl)-5-sulfanylidene-1,3-thiazolidin-3-yl]ethanone Traditional Name: 2-(benzofuran-2-yl)-1-[4-(dimethoxymethyl)-2-prolyl-5-thioxo-thiazolidin-3-yl]ethanone Formula: C21H24N2O5S2 MolecularWeight: 448.55566

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1C(=S)SC(N1C(=O)CC2=CC3=CC=CC=C3O2)C(=O)C4CCCN4)OC

Isomeric SMILES

COC(C1C(=S)SC(N1C(=O)CC2=CC3=CC=CC=C3O2)C(=O)C4CCCN4)OC

InChI

InChI=1S/C21H24N2O5S2/c1-26-20(27-2)17-21(29)30-19(18(25)14-7-5-9-22-14)23(17)16(24)11-13-10-12-6-3-4-8-15(12)28-13/h3-4,6,8,10,14,17,19-20,22H,5,7,9,11H2,1-2H3