(2R,3S)-N-(oxan-2-yloxy)-2-oxidanyl-3-phenylsulfanyl-heptanamide

Systemtic Name: (2R,3S)-N-(oxan-2-yloxy)-2-oxidanyl-3-phenylsulfanyl-heptanamide Openeye Name: (2R,3S)-2-hydroxy-3-phenylsulfanyl-N-tetrahydropyran-2-yloxy-heptanamide CAS Name: (2R,3S)-2-hydroxy-N-(2-oxanyloxy)-3-(phenylthio)heptanamide IUPAC Name: (2R,3S)-2-hydroxy-N-(oxan-2-yloxy)-3-phenylsulfanylheptanamide Traditional Name: (2R,3S)-2-hydroxy-3-(phenylthio)-N-tetrahydropyran-2-yloxy-enanthamide Formula: C18H27NO4S MolecularWeight: 353.47628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C(=O)NOC1CCCCO1)O)SC2=CC=CC=C2

Isomeric SMILES

CCCC[C@@H]([C@@H](C(=O)NOC1CCCCO1)O)SC2=CC=CC=C2

InChI

InChI=1S/C18H27NO4S/c1-2-3-11-15(24-14-9-5-4-6-10-14)17(20)18(21)19-23-16-12-7-8-13-22-16/h4-6,9-10,15-17,20H,2-3,7-8,11-13H2,1H3,(H,19,21)/t15-,16?,17-/m0/s1