-ISIS-  08251613552D

 28 30  0  0  0  0  0  0  0  0999 V2000
   -2.6083    0.2417    0.0000 S   0  0  3  0  0  0  0  0  0  0  0  0
   -1.7333    0.7375    0.0000 N   0  0  3  0  0  0  0  0  0  0  0  0
   -3.4750    0.7583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7292   -1.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1250   -0.6083    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3667   -0.7167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5958   -0.7792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8792    0.2208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8583   -0.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7292   -2.2833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0500    0.2208    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8792   -0.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0167    0.7250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8583    0.2208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0167   -1.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4500    1.7583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3375    0.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4583   -1.2792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1875    1.7833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3083    2.2708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1958    0.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0500    2.2875    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.7208    1.7375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3250   -0.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1833    0.7250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0500   -0.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3250    0.2208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1833   -1.2667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  1  0  0  0  0
  4  9  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  2  0  0  0  0
  7  4  1  0  0  0  0
  8  2  1  0  0  0  0
  9 14  1  0  0  0  0
 10  4  2  0  0  0  0
 11 26  1  0  0  0  0
 12  8  2  0  0  0  0
 13  8  1  0  0  0  0
 14 13  2  0  0  0  0
 15 12  1  0  0  0  0
 16  3  2  0  0  0  0
 17  3  1  0  0  0  0
 18  7  1  0  0  0  0
 19 21  1  0  0  0  0
 20 16  1  0  0  0  0
 21 17  2  0  0  0  0
 22 19  1  0  0  0  0
 23  2  1  0  0  0  0
 24 18  1  0  0  0  0
 25 27  1  0  0  0  0
 26 28  2  0  0  0  0
 27 24  2  0  0  0  0
 28 24  1  0  0  0  0
 19 20  2  0  0  0  0
  9 15  2  0  0  0  0
 11 25  2  0  0  0  0
M  END
>  <ID> (STL101598)
STL101598

>  <Rotatable_Bonds> (STL101598)
1

>  <logP> (STL101598)
2.349

>  <PSA> (STL101598)
87.75

>  <H_Donors> (STL101598)
1

>  <H_Acceptors> (STL101598)
3

>  <Number_of_rings> (STL101598)
3

>  <NAME> (STL101598)
4-{[(4-chlorophenyl)sulfonyl](methyl)amino}-N-(pyridin-4-ylmethyl)benzamide

>  <Mol_Weight> (STL101598)
415.90

>  <Mol_Formula> (STL101598)
C20H18ClN3O3S

>  <Smiles> (STL101598)
Clc1ccc(cc1)S(=O)(=O)N(c1ccc(cc1)C(=O)NCc1ccncc1)C

$$$$