S-(2-pyrrolidin-1-ylcarbonylpyrrolidin-1-yl) 3-(1-benzofuran-2-yl)propanethioate

Systemtic Name: S-(2-pyrrolidin-1-ylcarbonylpyrrolidin-1-yl) 3-(1-benzofuran-2-yl)propanethioate Openeye Name: S-[2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl] 3-(benzofuran-2-yl)propanethioate CAS Name: 3-(2-benzofuranyl)propanethioic acid S-[2-[oxo(1-pyrrolidinyl)methyl]-1-pyrrolidinyl] ester IUPAC Name: S-[2-(pyrrolidine-1-carbonyl)pyrrolidin-1-yl] 3-(1-benzofuran-2-yl)propanethioate Traditional Name: 3-(benzofuran-2-yl)propanethioic acid S-[2-(pyrrolidine-1-carbonyl)pyrrolidino] ester Formula: C20H24N2O3S MolecularWeight: 372.48116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CCCN2SC(=O)CCC3=CC4=CC=CC=C4O3

Isomeric SMILES

C1CCN(C1)C(=O)C2CCCN2SC(=O)CCC3=CC4=CC=CC=C4O3

InChI

InChI=1S/C20H24N2O3S/c23-19(10-9-16-14-15-6-1-2-8-18(15)25-16)26-22-13-5-7-17(22)20(24)21-11-3-4-12-21/h1-2,6,8,14,17H,3-5,7,9-13H2