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4-[(S)-oxidanyl-[(3R)-4-oxidanylidenethian-3-yl]methyl]benzenecarbonitrile

4-[(S)-oxidanyl-[(3R)-4-oxidanylidenethian-3-yl]methyl]benzenecarbonitrile

Systemtic Name:4-[(S)-oxidanyl-[(3R)-4-oxidanylidenethian-3-yl]methyl]benzenecarbonitrile
Openeye Name:4-[(S)-hydroxy-[(3R)-4-oxotetrahydrothiopyran-3-yl]methyl]benzonitrile
CAS Name:4-[(S)-hydroxy-[(3R)-4-oxo-3-thianyl]methyl]benzonitrile
IUPAC Name:4-[(S)-hydroxy-[(3R)-4-oxothian-3-yl]methyl]benzonitrile
Traditional Name:4-[(S)-hydroxy-[(3R)-4-ketotetrahydrothiopyran-3-yl]methyl]benzonitrile
Formula: C13H13NO2S
MolecularWeight: 247.31282
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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC(C1=O)C(C2=CC=C(C=C2)C#N)O


Isomeric SMILES

C1CSC[C@@H](C1=O)[C@@H](C2=CC=C(C=C2)C#N)O


InChI

InChI=1S/C13H13NO2S/c14-7-9-1-3-10(4-2-9)13(16)11-8-17-6-5-12(11)15/h1-4,11,13,16H,5-6,8H2/t11-,13+/m0/s1


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