
 OpenBabel04291915483D

 57 61  0  0  0  0  0  0  0  0999 V2000
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   -2.5875   -2.2964   -7.4548 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6415   -3.1108   -8.5213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9043   -4.4173   -8.3559 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9584   -5.2316   -9.4223 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2125   -6.4952   -9.2623 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7962   -2.7886   -6.2229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7381   -1.9130   -5.0762 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9469   -2.4052   -3.8443 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2294   -3.8100   -3.6664 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2835   -4.6244   -4.7328 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5463   -5.9309   -4.5674 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5985   -6.7184   -5.5988 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8527   -7.9820   -5.4388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4382   -4.3022   -2.4345 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8946   -1.6176   -2.8129 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6139   -0.2220   -2.9896 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4243    0.0651   -4.4311 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1496    1.3156   -4.8362 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9778    1.5758   -6.1425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1686    1.2889   -4.7011 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0618    1.6065   -4.0355 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1867    2.0080   -4.2369 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4286   -0.0051   -4.5372 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7031    2.8263   -6.5476 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5313    3.0865   -7.8539 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2282    4.4665   -8.3009 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2186    5.2773   -7.9394 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0936    4.8751   -7.7400 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1004    4.4857   -9.6247 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5272   -0.9253   -5.3322 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0896   -2.0774   -1.6620 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4840   -0.6494   -5.2362 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2468   -0.0159   -6.4860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4556   -0.5081   -5.2541 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4015    0.3062   -4.1876 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6102   -0.1860   -2.9557 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5562    0.6284   -1.8892 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9840    1.2906   -6.6514 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7133    1.9290   -8.2494 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.4811   -2.7325   -9.4680 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0647   -4.7955   -7.4092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7980   -4.8534  -10.3690 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1231   -4.2461   -5.6795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7067   -6.3091   -3.6207 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0113   -8.9612   -5.7233 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4823   -4.0410   -1.4370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7228    0.0331   -2.4549 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4324    0.3566   -2.6153 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0705    2.0767   -4.1438 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6241    3.5874   -5.8552 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7094   -1.9364   -5.4292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6575   -1.5121   -5.1269 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1996    1.3103   -4.3147 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8122   -1.1900   -2.8285 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5999    0.8917   -0.8923 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2 35  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  8  1  0  0  0  0
  4  5  1  0  0  0  0
  4 42  1  0  0  0  0
  5  6  2  0  0  0  0
  5 43  1  0  0  0  0
  6  7  1  0  0  0  0
  6 44  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
  9 34  1  0  0  0  0
 10 17  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 16  1  0  0  0  0
 12 13  1  0  0  0  0
 12 45  1  0  0  0  0
 13 14  2  0  0  0  0
 13 46  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 47  1  0  0  0  0
 16 48  1  0  0  0  0
 17 33  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 18 49  1  0  0  0  0
 18 50  1  0  0  0  0
 19 20  2  0  0  0  0
 19 32  1  0  0  0  0
 20 21  1  0  0  0  0
 20 51  1  0  0  0  0
 21 26  2  0  0  0  0
 21 22  1  0  0  0  0
 22 25  1  0  0  0  0
 22 24  1  0  0  0  0
 22 23  1  0  0  0  0
 26 27  1  0  0  0  0
 26 52  1  0  0  0  0
 27 28  1  0  0  0  0
 27 32  2  0  0  0  0
 28 31  1  0  0  0  0
 28 30  1  0  0  0  0
 28 29  1  0  0  0  0
 32 53  1  0  0  0  0
 33 34  2  0  0  0  0
 35 36  2  0  0  0  0
 35 40  1  0  0  0  0
 36 37  1  0  0  0  0
 36 54  1  0  0  0  0
 37 38  2  0  0  0  0
 37 55  1  0  0  0  0
 38 39  1  0  0  0  0
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 39 40  2  0  0  0  0
 39 57  1  0  0  0  0
 40 41  1  0  0  0  0
M  END
>  <SKU>
A16918

>  <Product Name>
Tradipitant

>  <CAS>
622370-35-8

>  <M.Wt>
587.9029592

>  <Formula>
C28H16ClF6N5O

>  <Synonyms>
LY-686017, LY 686017, LY686017, VLY 686, VLY686, VLY-686

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

$$$$
