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

Systemtic Name: [3-(1-benzofuran-2-ylcarbonyl)-2-(dimethoxymethyl)-4-sulfanylidene-pyrrolidin-1-yl]-pyrrolidin-2-yl-methanone Openeye Name: [3-(benzofuran-2-carbonyl)-2-(dimethoxymethyl)-4-thioxo-pyrrolidin-1-yl]-pyrrolidin-2-yl-methanone CAS Name: [3-[2-benzofuranyl(oxo)methyl]-2-(dimethoxymethyl)-4-sulfanylidene-1-pyrrolidinyl]-(2-pyrrolidinyl)methanone IUPAC Name: [3-(1-benzofuran-2-carbonyl)-2-(dimethoxymethyl)-4-sulfanylidenepyrrolidin-1-yl]-pyrrolidin-2-ylmethanone Traditional Name: [3-(benzofuran-2-carbonyl)-2-(dimethoxymethyl)-4-thioxo-pyrrolidino]-pyrrolidin-2-yl-methanone Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1C(C(=S)CN1C(=O)C2CCCN2)C(=O)C3=CC4=CC=CC=C4O3)OC

Isomeric SMILES

COC(C1C(C(=S)CN1C(=O)C2CCCN2)C(=O)C3=CC4=CC=CC=C4O3)OC

InChI

InChI=1S/C21H24N2O5S/c1-26-21(27-2)18-17(16(29)11-23(18)20(25)13-7-5-9-22-13)19(24)15-10-12-6-3-4-8-14(12)28-15/h3-4,6,8,10,13,17-18,21-22H,5,7,9,11H2,1-2H3