
 OpenBabel04291915343D

 59 62  0  0  0  0  0  0  0  0999 V2000
   -7.2198    3.4477   -8.6653 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8769    3.0278   -7.6076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1549    2.5674   -6.4449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9273    2.5684   -6.4445 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8531    2.1211   -5.3209 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1549    1.6759   -4.1964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8263    1.2468   -3.1155 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1549    0.8176   -2.0345 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8120    0.8176   -2.0345 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1405    0.3884   -0.9536 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8263    2.1051   -5.2773 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7976    0.3884   -0.9536 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1482    0.8035   -1.9990 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7976    1.2185   -3.0443 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1626    1.2326   -3.0799 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0993   -0.0579    0.1704 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7028   -0.0579    0.1704 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0314   -0.4871    1.2513 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3116   -0.4871    1.2513 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9830   -0.0579    0.1704 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3259   -0.0579    0.1704 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0314    0.3713   -0.9105 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3370    0.3550   -0.8695 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4304   -0.4857    1.2519 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -9.1753    1.2468   -3.1155 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8688    0.8035   -1.9991 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3632    0.9060   -2.2572 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.1232    0.4202   -1.0338 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5685    0.5194   -1.2834 N   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3035    0.0496   -0.1002 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.7979    0.1521   -0.3584 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.5079   -0.3017    0.7846 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.9040   -0.2060    0.5434 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.9236   -0.3117   -2.4428 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7358    3.7767   -9.4963 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1878    3.4485   -8.6650 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9089    3.0270   -7.6080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8376    2.1204   -5.3212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6709    0.4878   -1.2039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3423    2.4349   -6.1080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2691    1.5456   -3.8682 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5916   -0.3725    0.9628 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5474   -0.8169    2.0820 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3436   -0.1211    0.3296 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3919    0.7281   -1.8092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6103    1.4084   -1.1552 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6103   -0.2155   -1.8000 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.6217    0.3011   -3.1011 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.6217    1.9250   -2.4563 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8648    1.0252   -0.1899 H   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8648   -0.5988   -0.8347 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.0450    0.6545    0.7437 H   0  0  0  0  0  0  0  0  0  0  0  0
  -14.0450   -0.9695    0.0989 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.0564   -0.4529   -1.2023 H   0  0  0  0  0  0  0  0  0  0  0  0
  -16.0564    1.1711   -0.5575 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.4509    0.6950    0.7278 H   0  0  0  0  0  0  0  0  0  0  0  0
  -18.8109   -0.7432    0.7273 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.4146   -1.2457   -2.5587 H   0  0  0  0  0  0  0  0  0  0  0  0
  -13.8565   -0.0787   -3.4849 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1 35  1  0  0  0  0
  1 36  1  0  0  0  0
  2  3  1  0  0  0  0
  2 37  1  0  0  0  0
  3  5  1  0  0  0  0
  3  4  2  0  0  0  0
  5  6  1  0  0  0  0
  5 38  1  0  0  0  0
  6  7  2  0  0  0  0
  6 11  1  0  0  0  0
  7 25  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 39  1  0  0  0  0
  9 10  1  0  0  0  0
  9 15  1  0  0  0  0
 10 12  1  0  0  0  0
 10 11  2  0  0  0  0
 11 40  1  0  0  0  0
 12 16  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 41  1  0  0  0  0
 16 17  1  0  0  0  0
 16 42  1  0  0  0  0
 17 18  2  0  0  0  0
 17 22  1  0  0  0  0
 18 19  1  0  0  0  0
 18 43  1  0  0  0  0
 19 24  1  0  0  0  0
 19 20  2  0  0  0  0
 20 23  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 44  1  0  0  0  0
 22 45  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 46  1  0  0  0  0
 26 47  1  0  0  0  0
 27 28  1  0  0  0  0
 27 48  1  0  0  0  0
 27 49  1  0  0  0  0
 28 29  1  0  0  0  0
 28 50  1  0  0  0  0
 28 51  1  0  0  0  0
 29 30  1  0  0  0  0
 29 34  1  0  0  0  0
 30 31  1  0  0  0  0
 30 52  1  0  0  0  0
 30 53  1  0  0  0  0
 31 32  1  0  0  0  0
 31 54  1  0  0  0  0
 31 55  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 33 56  1  0  0  0  0
 33 57  1  0  0  0  0
 34 58  1  0  0  0  0
 34 59  1  0  0  0  0
M  END
>  <SKU>
A10211

>  <Product Name>
Canertinib (CI-1033)

>  <CAS>
267243-28-7

>  <M.Wt>
485.9384032

>  <Formula>
C24H25ClFN5O3

>  <Synonyms>
CI-1033, CI1033,  PD-183805

>  <URL>
https://www.adooq.com/canertinib-ci-1033.html

$$$$
