-ISIS-  08091621332D

 15 15  0  0  0  0  0  0  0  0999 V2000
    0.2875   -1.2833    0.0000 S   0  0  3  0  0  0  0  0  0  0  0  0
   -0.5958   -0.7958    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7917   -0.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1625   -1.8083    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2375   -2.1583    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4458   -1.2833    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.3042    0.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8042   -0.4042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8042    1.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2917    2.1625    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7917    1.2875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3167    0.4375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3208   -1.7833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9583   -0.4042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9583   -2.1333    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  1  2  0  0  0  0
  5  1  2  0  0  0  0
  6  2  1  0  0  0  0
  7  3  1  0  0  0  0
  8  3  2  0  0  0  0
  9 12  2  0  0  0  0
 10  9  1  0  0  0  0
 11  7  2  0  0  0  0
 12  8  1  0  0  0  0
 13  6  1  0  0  0  0
 14  6  1  0  0  0  0
 15  6  1  0  0  0  0
 11  9  1  0  0  0  0
M  END
>  <ID> (BBL000310)
BBL000310

>  <Rotatable_Bonds> (BBL000310)
0

>  <logP> (BBL000310)
1.219

>  <PSA> (BBL000310)
80.57

>  <H_Donors> (BBL000310)
3

>  <H_Acceptors> (BBL000310)
2

>  <Number_of_rings> (BBL000310)
1

>  <NAME> (BBL000310)
4-amino-N-tert-butylbenzenesulfonamide

>  <Mol_Weight> (BBL000310)
228.32

>  <Mol_Formula> (BBL000310)
C10H16N2O2S

>  <Smiles> (BBL000310)
CC(NS(=O)(=O)c1ccc(cc1)N)(C)C

>  <CAS_Number> (BBL000310)
209917-48-6

>  <Alternative_identifier> (BBL000310)
MFCD04115090

$$$$