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

Systemtic Name: S-(2-pyrrolidin-3-ylcarbonylpyrrolidin-1-yl) 1-benzofuran-2-carbothioate Openeye Name: S-[2-(pyrrolidine-3-carbonyl)pyrrolidin-1-yl] benzofuran-2-carbothioate CAS Name: 2-benzofurancarbothioic acid S-[2-[oxo(3-pyrrolidinyl)methyl]-1-pyrrolidinyl] ester IUPAC Name: S-[2-(pyrrolidine-3-carbonyl)pyrrolidin-1-yl] 1-benzofuran-2-carbothioate Traditional Name: benzofuran-2-carbothioic acid S-[2-(pyrrolidine-3-carbonyl)pyrrolidino] ester Formula: C18H20N2O3S MolecularWeight: 344.428

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)SC(=O)C2=CC3=CC=CC=C3O2)C(=O)C4CCNC4

Isomeric SMILES

C1CC(N(C1)SC(=O)C2=CC3=CC=CC=C3O2)C(=O)C4CCNC4

InChI

InChI=1S/C18H20N2O3S/c21-17(13-7-8-19-11-13)14-5-3-9-20(14)24-18(22)16-10-12-4-1-2-6-15(12)23-16/h1-2,4,6,10,13-14,19H,3,5,7-9,11H2