-ISIS-  08091621332D

 17 18  0  0  0  0  0  0  0  0999 V2000
   -1.4417    2.5833    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8042    1.6458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1917    1.5583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4542    2.5208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0292    1.0125    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.7750    1.2833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7708    1.4083    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.1792    3.3083    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5542   -1.6167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8167   -2.5875    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
    1.0292    0.3208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5792   -1.3500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2542   -0.9125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3167   -0.3917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9917    0.0583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1167   -3.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7667   -2.8417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  4  1  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  3  2  0  0  0  0
  7  2  2  0  0  0  0
  8  4  2  0  0  0  0
  9 13  1  0  0  0  0
 10  9  1  0  0  0  0
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 12 14  1  0  0  0  0
 13 15  2  0  0  0  0
 14 11  2  0  0  0  0
 15 11  1  0  0  0  0
 16 10  1  0  0  0  0
 17 10  1  0  0  0  0
  3  5  1  0  0  0  0
  9 12  2  0  0  0  0
M  END
>  <ID> (BBL000763)
BBL000763

>  <Rotatable_Bonds> (BBL000763)
0

>  <logP> (BBL000763)
2.252

>  <PSA> (BBL000763)
89.73

>  <H_Donors> (BBL000763)
1

>  <H_Acceptors> (BBL000763)
1

>  <Number_of_rings> (BBL000763)
2

>  <NAME> (BBL000763)
(5Z)-5-[4-(dimethylamino)benzylidene]-2-thioxo-1,3-thiazolidin-4-one

>  <Mol_Weight> (BBL000763)
264.37

>  <Mol_Formula> (BBL000763)
C12H12N2OS2

>  <Smiles> (BBL000763)
CN(c1ccc(cc1)/C=C/1\SC(=S)NC1=O)C

>  <Alternative_identifier> (BBL000763)
MFCD00005274

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