
 OpenBabel04291915363D

 44 45  0  0  0  0  0  0  0  0999 V2000
    1.3541   -1.3961    0.0670 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5894   -0.0754    0.0035 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8520    0.3814   -0.0177 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0873    1.7020   -0.0811 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3499    2.1589   -0.1023 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0915   -1.8529    0.0882 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5851    3.4795   -0.1657 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5915    4.3149   -0.2066 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4120    3.8881   -0.1867 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0599    2.5658   -0.1233 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7468    2.0907   -0.1013 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3215    2.9890   -0.1452 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5842    2.5321   -0.1240 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6116    3.3959   -0.1662 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8742    2.9390   -0.1450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1095    1.6184   -0.0816 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0863    4.3096   -0.2086 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2069    4.0595   -0.1998 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    5.9785    3.9837   -0.1891 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9672    5.4640   -0.2604 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1250    6.1436   -0.2924 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1146    7.4849   -0.3569 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2344    8.1422   -0.3879 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2244    9.4394   -0.4503 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7990    6.1257   -0.2930 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9576    0.0905   -0.0045 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.9576    0.0905   -0.0045 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.1437   -2.0599    0.0994 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7998    0.5883   -0.0289 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6415   -0.2824    0.0148 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7873   -2.3934    0.1136 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5744    1.1226   -0.0548 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7650    1.5172   -0.0752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4308    4.4108   -0.2149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6736    0.7552   -0.0404 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4779    5.1728   -0.2498 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4862    3.5894   -1.0445 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4851    3.6734    0.7008 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0226    5.6351   -0.2673 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2170    7.9934   -0.3820 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6233   10.3901   -0.4959 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7753    5.9953   -0.2873 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2876    0.0905   -0.0045 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2876    0.0905   -0.0045 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 28  1  0  0  0  0
  2  3  1  0  0  0  0
  2 29  1  0  0  0  0
  3  4  2  0  0  0  0
  3 30  1  0  0  0  0
  4  5  1  0  0  0  0
  4 10  1  0  0  0  0
  5  7  1  0  0  0  0
  5  6  2  0  0  0  0
  6 31  1  0  0  0  0
  7 19  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 32  1  0  0  0  0
 12 13  2  0  0  0  0
 12 17  1  0  0  0  0
 13 14  1  0  0  0  0
 13 33  1  0  0  0  0
 14 15  2  0  0  0  0
 14 34  1  0  0  0  0
 15 18  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 35  1  0  0  0  0
 17 36  1  0  0  0  0
 19 20  1  0  0  0  0
 19 37  1  0  0  0  0
 19 38  1  0  0  0  0
 20 21  2  0  0  0  0
 20 25  1  0  0  0  0
 21 22  1  0  0  0  0
 21 39  1  0  0  0  0
 22 23  2  0  0  0  0
 22 40  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 24 41  1  0  0  0  0
 25 42  1  0  0  0  0
 26 43  1  0  0  0  0
 27 44  1  0  0  0  0
M  END
>  <SKU>
A10967

>  <Product Name>
Vatalanib (PTK787) 2HCl

>  <CAS>
212141-54-3

>  <M.Wt>
419.73478

>  <Formula>
C20H17Cl3N4

>  <Synonyms>
Vatalanib,PTK787,PTK/ZK

>  <URL>
https://www.adooq.com/vatalanib-ptk787-dihydrochloride-base.html

$$$$
