1-[1-(1-benzofuran-2-ylcarbonyl)pyrrolidin-2-yl]carbonylpyrrolidine-2-carbothioic S-acid

Systemtic Name: 1-[1-(1-benzofuran-2-ylcarbonyl)pyrrolidin-2-yl]carbonylpyrrolidine-2-carbothioic S-acid Openeye Name: 1-[1-(benzofuran-2-carbonyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carbothioic S-acid CAS Name: 1-[[1-[2-benzofuranyl(oxo)methyl]-2-pyrrolidinyl]-oxomethyl]-2-pyrrolidinecarbothioic S-acid IUPAC Name: 1-[1-(1-benzofuran-2-carbonyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carbothioic S-acid Traditional Name: 1-[1-(benzofuran-2-carbonyl)prolyl]pyrrolidine-2-carbothioic S-acid Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCCN2C(=O)C3=CC4=CC=CC=C4O3)C(=O)S

Isomeric SMILES

C1CC(N(C1)C(=O)C2CCCN2C(=O)C3=CC4=CC=CC=C4O3)C(=O)S

InChI

InChI=1S/C19H20N2O4S/c22-17(21-10-4-7-14(21)19(24)26)13-6-3-9-20(13)18(23)16-11-12-5-1-2-8-15(12)25-16/h1-2,5,8,11,13-14H,3-4,6-7,9-10H2,(H,24,26)