S-(2-pyrrolidin-3-ylcarbonylpyrrolidin-1-yl) 1,2,3,4-tetrahydronaphthalene-2-carbothioate

Systemtic Name: S-(2-pyrrolidin-3-ylcarbonylpyrrolidin-1-yl) 1,2,3,4-tetrahydronaphthalene-2-carbothioate Openeye Name: S-[2-(pyrrolidine-3-carbonyl)pyrrolidin-1-yl] tetralin-2-carbothioate CAS Name: 1,2,3,4-tetrahydronaphthalene-2-carbothioic acid S-[2-[oxo(3-pyrrolidinyl)methyl]-1-pyrrolidinyl] ester IUPAC Name: S-[2-(pyrrolidine-3-carbonyl)pyrrolidin-1-yl] 1,2,3,4-tetrahydronaphthalene-2-carbothioate Traditional Name: tetralin-2-carbothioic 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)C2CCC3=CC=CC=C3C2)C(=O)C4CCNC4

Isomeric SMILES

C1CC(N(C1)SC(=O)C2CCC3=CC=CC=C3C2)C(=O)C4CCNC4

InChI

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