(3R,4S)-4-ethyl-3-methyl-3-pyridin-2-ylsulfanyl-oxolane-2,5-dione

Systemtic Name: (3R,4S)-4-ethyl-3-methyl-3-pyridin-2-ylsulfanyl-oxolane-2,5-dione Openeye Name: (3R,4S)-4-ethyl-3-methyl-3-(2-pyridylsulfanyl)tetrahydrofuran-2,5-dione CAS Name: (3R,4S)-4-ethyl-3-methyl-3-(2-pyridinylthio)oxolane-2,5-dione IUPAC Name: (3R,4S)-4-ethyl-3-methyl-3-pyridin-2-ylsulfanyloxolane-2,5-dione Traditional Name: (3R,4S)-4-ethyl-3-methyl-3-(2-pyridylthio)tetrahydrofuran-2,5-quinone Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)OC(=O)C1(C)SC2=CC=CC=N2

Isomeric SMILES

CC[C@H]1C(=O)OC(=O)[C@]1(C)SC2=CC=CC=N2

InChI

InChI=1S/C12H13NO3S/c1-3-8-10(14)16-11(15)12(8,2)17-9-6-4-5-7-13-9/h4-8H,3H2,1-2H3/t8-,12+/m0/s1