-ISIS-  08251614502D

 17 17  0  0  0  0  0  0  0  0999 V2000
   -1.7583    0.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2333   -0.8708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2542   -0.8708    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7583    0.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2625   -0.0083    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7500   -1.7333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7375   -0.0083    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7375   -1.7333    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2583    1.7208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2625    1.7208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7500   -1.7333    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7375    2.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2583   -0.0083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2542   -2.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2542    1.7208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2542   -0.0083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7542    0.8542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  7  1  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  3  1  0  0  0  0
  7  5  1  0  0  0  0
  8  2  2  0  0  0  0
  9  1  1  0  0  0  0
 10  4  2  0  0  0  0
 11  6  2  0  0  0  0
 12  9  1  0  0  0  0
 13  1  2  0  0  0  0
 14  6  1  0  0  0  0
 15  9  2  0  0  0  0
 16 13  1  0  0  0  0
 17 16  2  0  0  0  0
 15 17  1  0  0  0  0
M  END
>  <ID> (STK692370)
STK692370

>  <Rotatable_Bonds> (STK692370)
5

>  <logP> (STK692370)
1.979

>  <PSA> (STK692370)
135.82

>  <H_Donors> (STK692370)
3

>  <H_Acceptors> (STK692370)
3

>  <Number_of_rings> (STK692370)
1

>  <NAME> (STK692370)
acetic 2-[(2-hydroxyphenyl)carbonyl]hydrazinecarbothioic thioanhydride

>  <Mol_Weight> (STK692370)
270.33

>  <Mol_Formula> (STK692370)
C10H10N2O3S2

>  <Smiles> (STK692370)
CC(=O)SC(=S)NNC(=O)c1ccccc1O

$$$$