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

Systemtic Name: 3-(1-benzofuran-2-yl)-1-[4-(dimethoxymethyl)-2-pyrrolidin-2-ylcarbonyl-5-sulfanylidene-1,3-thiazolidin-2-yl]propan-1-one Openeye Name: 3-(benzofuran-2-yl)-1-[4-(dimethoxymethyl)-2-(pyrrolidine-2-carbonyl)-5-thioxo-thiazolidin-2-yl]propan-1-one CAS Name: 3-(2-benzofuranyl)-1-[4-(dimethoxymethyl)-2-[oxo(2-pyrrolidinyl)methyl]-5-sulfanylidene-2-thiazolidinyl]-1-propanone IUPAC Name: 3-(1-benzofuran-2-yl)-1-[4-(dimethoxymethyl)-2-(pyrrolidine-2-carbonyl)-5-sulfanylidene-1,3-thiazolidin-2-yl]propan-1-one Traditional Name: 3-(benzofuran-2-yl)-1-[4-(dimethoxymethyl)-2-prolyl-5-thioxo-thiazolidin-2-yl]propan-1-one Formula: C22H26N2O5S2 MolecularWeight: 462.58224

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1C(=S)SC(N1)(C(=O)CCC2=CC3=CC=CC=C3O2)C(=O)C4CCCN4)OC

Isomeric SMILES

COC(C1C(=S)SC(N1)(C(=O)CCC2=CC3=CC=CC=C3O2)C(=O)C4CCCN4)OC

InChI

InChI=1S/C22H26N2O5S2/c1-27-20(28-2)18-21(30)31-22(24-18,19(26)15-7-5-11-23-15)17(25)10-9-14-12-13-6-3-4-8-16(13)29-14/h3-4,6,8,12,15,18,20,23-24H,5,7,9-11H2,1-2H3