S-(2-pyrrolidin-3-ylcarbonylpyrrolidin-1-yl) 2-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanethioate

Systemtic Name: S-(2-pyrrolidin-3-ylcarbonylpyrrolidin-1-yl) 2-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanethioate Openeye Name: S-[2-(pyrrolidine-3-carbonyl)pyrrolidin-1-yl] 2-tetralin-2-ylethanethioate CAS Name: 2-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanethioic acid S-[2-[oxo(3-pyrrolidinyl)methyl]-1-pyrrolidinyl] ester IUPAC Name: S-[2-(pyrrolidine-3-carbonyl)pyrrolidin-1-yl] 2-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanethioate Traditional Name: 2-tetralin-2-ylethanethioic acid S-[2-(pyrrolidine-3-carbonyl)pyrrolidino] ester Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)SC(=O)CC2CCC3=CC=CC=C3C2)C(=O)C4CCNC4

Isomeric SMILES

C1CC(N(C1)SC(=O)CC2CCC3=CC=CC=C3C2)C(=O)C4CCNC4

InChI

InChI=1S/C21H28N2O2S/c24-20(13-15-7-8-16-4-1-2-5-17(16)12-15)26-23-11-3-6-19(23)21(25)18-9-10-22-14-18/h1-2,4-5,15,18-19,22H,3,6-14H2