-ISIS-  08091621332D

 18 19  0  0  0  0  0  0  0  0999 V2000
    0.9667   -0.1333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2917    0.6125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0833    0.2083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4625   -0.9958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6125    0.2083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3500    0.2083    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5125   -0.7958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9667   -0.0333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4833    0.7083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0833   -0.7958    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2250    0.7083    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5458   -0.8333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3708    0.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9458    0.7083    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9542    0.1875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3583    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5458   -0.7208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9417    0.2958    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3 11  1  0  0  0  0
  4  1  2  0  0  0  0
  5  2  1  0  0  0  0
  6  9  2  0  0  0  0
  7  4  1  0  0  0  0
  8  1  1  0  0  0  0
  9  5  1  0  0  0  0
 10  3  2  0  0  0  0
 11  6  1  0  0  0  0
 12  8  2  0  0  0  0
 13  8  1  0  0  0  0
 14  3  1  0  0  0  0
 15 16  1  0  0  0  0
 16 13  2  0  0  0  0
 17 12  1  0  0  0  0
 18 15  1  0  0  0  0
  5  7  2  0  0  0  0
 17 15  2  0  0  0  0
M  END
>  <ID> (BBL000490)
BBL000490

>  <Rotatable_Bonds> (BBL000490)
1

>  <logP> (BBL000490)
3.01

>  <PSA> (BBL000490)
95.64

>  <H_Donors> (BBL000490)
3

>  <H_Acceptors> (BBL000490)
1

>  <Number_of_rings> (BBL000490)
2

>  <NAME> (BBL000490)
(2E)-2-{[5-(4-chlorophenyl)furan-2-yl]methylidene}hydrazinecarbothioamide

>  <Mol_Weight> (BBL000490)
279.75

>  <Mol_Formula> (BBL000490)
C12H10ClN3OS

>  <Smiles> (BBL000490)
NC(=S)N/N=C/c1ccc(o1)c1ccc(cc1)Cl

>  <Alternative_identifier> (BBL000490)
MFCD00695933

$$$$