(3R,4R)-3,4-bis(fluoranyl)-1-methyl-3-phenylsulfanyl-piperidin-2-one

Systemtic Name: (3R,4R)-3,4-bis(fluoranyl)-1-methyl-3-phenylsulfanyl-piperidin-2-one Openeye Name: (3R,4R)-3,4-difluoro-1-methyl-3-phenylsulfanyl-piperidin-2-one CAS Name: (3R,4R)-3,4-difluoro-1-methyl-3-(phenylthio)-2-piperidinone IUPAC Name: (3R,4R)-3,4-difluoro-1-methyl-3-phenylsulfanylpiperidin-2-one Traditional Name: (3R,4R)-3,4-difluoro-1-methyl-3-(phenylthio)-2-piperidone Formula: C12H13F2NOS MolecularWeight: 257.299526

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1=O)(F)SC2=CC=CC=C2)F

Isomeric SMILES

CN1CC[C@H]([C@](C1=O)(F)SC2=CC=CC=C2)F

InChI

InChI=1S/C12H13F2NOS/c1-15-8-7-10(13)12(14,11(15)16)17-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3/t10-,12+/m1/s1