1-[3-[(2R)-2-oxidanyl-3-pyrimidin-2-ylsulfanyl-propoxy]phenyl]ethanone

Systemtic Name: 1-[3-[(2R)-2-oxidanyl-3-pyrimidin-2-ylsulfanyl-propoxy]phenyl]ethanone Openeye Name: 1-[3-[(2R)-2-hydroxy-3-pyrimidin-2-ylsulfanyl-propoxy]phenyl]ethanone CAS Name: 1-[3-[(2R)-2-hydroxy-3-(2-pyrimidinylthio)propoxy]phenyl]ethanone IUPAC Name: 1-[3-[(2R)-2-hydroxy-3-pyrimidin-2-ylsulfanylpropoxy]phenyl]ethanone Traditional Name: 1-[3-[(2R)-2-hydroxy-3-(2-pyrimidylthio)propoxy]phenyl]ethanone Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OCC(CSC2=NC=CC=N2)O

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OC[C@H](CSC2=NC=CC=N2)O

InChI

InChI=1S/C15H16N2O3S/c1-11(18)12-4-2-5-14(8-12)20-9-13(19)10-21-15-16-6-3-7-17-15/h2-8,13,19H,9-10H2,1H3/t13-/m1/s1