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

Systemtic Name: (3R,4S)-3-methyl-4-phenethyl-3-pyridin-2-ylsulfanyl-oxolane-2,5-dione Openeye Name: (3R,4S)-3-methyl-4-phenethyl-3-(2-pyridylsulfanyl)tetrahydrofuran-2,5-dione CAS Name: (3R,4S)-3-methyl-4-phenethyl-3-(2-pyridinylthio)oxolane-2,5-dione IUPAC Name: (3R,4S)-3-methyl-4-phenethyl-3-pyridin-2-ylsulfanyloxolane-2,5-dione Traditional Name: (3R,4S)-3-methyl-4-phenethyl-3-(2-pyridylthio)tetrahydrofuran-2,5-quinone Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)OC1=O)CCC2=CC=CC=C2)SC3=CC=CC=N3

Isomeric SMILES

C[C@]1([C@H](C(=O)OC1=O)CCC2=CC=CC=C2)SC3=CC=CC=N3

InChI

InChI=1S/C18H17NO3S/c1-18(23-15-9-5-6-12-19-15)14(16(20)22-17(18)21)11-10-13-7-3-2-4-8-13/h2-9,12,14H,10-11H2,1H3/t14-,18+/m0/s1