1-[(2R,3S)-2-methylsulfanyl-3-oxidanyl-heptyl]pyridin-2-one

Systemtic Name: 1-[(2R,3S)-2-methylsulfanyl-3-oxidanyl-heptyl]pyridin-2-one Openeye Name: 1-[(2R,3S)-3-hydroxy-2-methylsulfanyl-heptyl]pyridin-2-one CAS Name: 1-[(2R,3S)-3-hydroxy-2-(methylthio)heptyl]-2-pyridinone IUPAC Name: 1-[(2R,3S)-3-hydroxy-2-methylsulfanylheptyl]pyridin-2-one Traditional Name: 1-[(2R,3S)-3-hydroxy-2-(methylthio)heptyl]-2-pyridone Formula: C13H21NO2S MolecularWeight: 255.37634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CN1C=CC=CC1=O)SC)O

Isomeric SMILES

CCCC[C@@H]([C@@H](CN1C=CC=CC1=O)SC)O

InChI

InChI=1S/C13H21NO2S/c1-3-4-7-11(15)12(17-2)10-14-9-6-5-8-13(14)16/h5-6,8-9,11-12,15H,3-4,7,10H2,1-2H3/t11-,12+/m0/s1