tert-butyl 4-cyano-4-(4-(methylthio)phenyl)piperidine-1-carboxylate
  -molcms-06162602422D

 23 24  0  0  0  0  0  0  0  0999 V2000
   -4.5820    0.0715    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9392   -0.6946    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9544   -0.5209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6124    0.4187    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6276    0.5924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9848   -0.1736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3268   -1.1133    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3116   -1.2870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660    0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7321    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7321   -1.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5981   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5981   -2.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4641   -1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3301   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3301   -2.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1962   -1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1962   -2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3420    0.9397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6840    1.8794    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  3  1  0  0  0  0
  6  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 14  9  1  0  0  0  0
 12 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 18 21  1  0  0  0  0
  9 22  1  0  0  0  0
 22 23  3  0  0  0  0
M  END
>  <ProductName>
tert-butyl 4-cyano-4-(4-(methylthio)phenyl)piperidine-1-carboxylate

>  <CASNumber>
1673527-14-4

>  <MolecularFormula>
C18 H24 N2 O2 S

>  <MDLNo>


>  <MolWt>
332.46

>  <BoilingPoint>
477.5��45.0 ��C(Predicted)

>  <MeltingPoint>


>  <MolFile>


>  <Smiles>
CSC1=CC=C(C=C1)C1(CCN(CC1)C(=O)OC(C)(C)C)C#N

$$$$