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

Systemtic Name: 2-(1-benzofuran-2-yl)-1-[2-(dimethoxymethyl)-1-pyrrolidin-2-ylcarbonyl-4-sulfanylidene-pyrrolidin-3-yl]ethanone Openeye Name: 2-(benzofuran-2-yl)-1-[2-(dimethoxymethyl)-1-(pyrrolidine-2-carbonyl)-4-thioxo-pyrrolidin-3-yl]ethanone CAS Name: 2-(2-benzofuranyl)-1-[2-(dimethoxymethyl)-1-[oxo(2-pyrrolidinyl)methyl]-4-sulfanylidene-3-pyrrolidinyl]ethanone IUPAC Name: 2-(1-benzofuran-2-yl)-1-[2-(dimethoxymethyl)-1-(pyrrolidine-2-carbonyl)-4-sulfanylidenepyrrolidin-3-yl]ethanone Traditional Name: 2-(benzofuran-2-yl)-1-[2-(dimethoxymethyl)-1-prolyl-4-thioxo-pyrrolidin-3-yl]ethanone Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1C(C(=S)CN1C(=O)C2CCCN2)C(=O)CC3=CC4=CC=CC=C4O3)OC

Isomeric SMILES

COC(C1C(C(=S)CN1C(=O)C2CCCN2)C(=O)CC3=CC4=CC=CC=C4O3)OC

InChI

InChI=1S/C22H26N2O5S/c1-27-22(28-2)20-19(18(30)12-24(20)21(26)15-7-5-9-23-15)16(25)11-14-10-13-6-3-4-8-17(13)29-14/h3-4,6,8,10,15,19-20,22-23H,5,7,9,11-12H2,1-2H3