
 OpenBabel04291915383D

 29 29  0  0  1  0  0  0  0  0999 V2000
    2.9936    1.5178   -0.1718 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4869    0.0938   -0.0106 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.8436   -0.3092    0.9142 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9936   -0.7578   -1.1632 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3903   -2.4535   -0.9713 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.0049    0.0938   -0.0106 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3911   -0.9686   -0.0507 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3067    1.3023    0.0350 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1278    1.3023    0.0350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6345    2.7344    0.0890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1545    2.7344    0.0890 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0239    2.5437    0.0818 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.0759    2.3484    0.0745 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6659    3.2747    1.3203 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8171    4.6151    1.3400 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3783    2.6743    2.3517 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0636    1.5178   -0.1718 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6369    2.1172    0.6396 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6369    1.9207   -1.0966 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0636   -0.7578   -1.1632 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6369   -0.3549   -2.0881 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8436   -2.9656    0.2042 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4845    0.7653    0.8890 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4845    0.8312   -0.8571 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2778    3.2714   -0.7650 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2778    3.2055    0.9811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7721    2.7814   -0.7835 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0822    2.7354    0.6222 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0366    5.0734    0.5527 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  1 19  1  0  0  0  0
  2  4  1  0  0  0  0
  2  3  1  1  0  0  0
  2  6  1  0  0  0  0
  2  1  1  0  0  0  0
  4  5  1  0  0  0  0
  4 20  1  0  0  0  0
  4 21  1  0  0  0  0
  5 22  1  0  0  0  0
  6  8  1  0  0  0  0
  6  7  2  0  0  0  0
  8  9  1  0  0  0  0
  8 12  1  0  0  0  0
  9 10  1  0  0  0  0
  9 23  1  0  0  0  0
  9 24  1  0  0  0  0
 10 11  1  0  0  0  0
 10 25  1  0  0  0  0
 10 26  1  0  0  0  0
 11 12  1  0  0  0  0
 11 27  1  0  0  0  0
 11 28  1  0  0  0  0
 12 13  1  6  0  0  0
 12 14  1  0  0  0  0
 14 16  2  0  0  0  0
 14 15  1  0  0  0  0
 15 29  1  0  0  0  0
M  END
>  <SKU>
A11738

>  <Product Name>
Captopril

>  <CAS>
62571-86-2 

>  <M.Wt>
217.2853

>  <Formula>
C9H15NO3S

>  <Synonyms>
Capoten

>  <URL>
https://www.adooq.com/captopril.html

$$$$
