S-(2-pyrrolidin-3-ylcarbonylpyrrolidin-1-yl) 2-(2,3-dihydro-1H-inden-2-yl)ethanethioate

Systemtic Name: S-(2-pyrrolidin-3-ylcarbonylpyrrolidin-1-yl) 2-(2,3-dihydro-1H-inden-2-yl)ethanethioate Openeye Name: S-[2-(pyrrolidine-3-carbonyl)pyrrolidin-1-yl] 2-indan-2-ylethanethioate CAS Name: 2-(2,3-dihydro-1H-inden-2-yl)ethanethioic acid S-[2-[oxo(3-pyrrolidinyl)methyl]-1-pyrrolidinyl] ester IUPAC Name: S-[2-(pyrrolidine-3-carbonyl)pyrrolidin-1-yl] 2-(2,3-dihydro-1H-inden-2-yl)ethanethioate Traditional Name: 2-indan-2-ylethanethioic acid S-[2-(pyrrolidine-3-carbonyl)pyrrolidino] ester Formula: C20H26N2O2S MolecularWeight: 358.49764

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)SC(=O)CC2CC3=CC=CC=C3C2)C(=O)C4CCNC4

Isomeric SMILES

C1CC(N(C1)SC(=O)CC2CC3=CC=CC=C3C2)C(=O)C4CCNC4

InChI

InChI=1S/C20H26N2O2S/c23-19(12-14-10-15-4-1-2-5-16(15)11-14)25-22-9-3-6-18(22)20(24)17-7-8-21-13-17/h1-2,4-5,14,17-18,21H,3,6-13H2