methyl (4R)-4-[(2R)-oxan-2-yl]oxy-2-pyridin-2-ylsulfanyl-pentanoate

Systemtic Name: methyl (4R)-4-[(2R)-oxan-2-yl]oxy-2-pyridin-2-ylsulfanyl-pentanoate Openeye Name: methyl (4R)-2-(2-pyridylsulfanyl)-4-[(2R)-tetrahydropyran-2-yl]oxy-pentanoate CAS Name: (4R)-4-[[(2R)-2-oxanyl]oxy]-2-(2-pyridinylthio)pentanoic acid methyl ester IUPAC Name: methyl (4R)-4-[(2R)-oxan-2-yl]oxy-2-pyridin-2-ylsulfanylpentanoate Traditional Name: (4R)-2-(2-pyridylthio)-4-[(2R)-tetrahydropyran-2-yl]oxy-valeric acid methyl ester Formula: C16H23NO4S MolecularWeight: 325.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C(=O)OC)SC1=CC=CC=N1)OC2CCCCO2

Isomeric SMILES

C[C@H](CC(C(=O)OC)SC1=CC=CC=N1)O[C@@H]2CCCCO2

InChI

InChI=1S/C16H23NO4S/c1-12(21-15-8-4-6-10-20-15)11-13(16(18)19-2)22-14-7-3-5-9-17-14/h3,5,7,9,12-13,15H,4,6,8,10-11H2,1-2H3/t12-,13?,15-/m1/s1