
 OpenBabel04291915413D

 53 55  0  0  0  0  0  0  0  0999 V2000
    9.1060    4.7181    0.8374 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4125    3.5353    0.6280 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0635    3.5357    0.6258 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3920    2.3905    0.4231 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0491    2.3907    0.4220 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3777    3.5361    0.6236 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0347    3.5363    0.6225 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4064    3.5355    0.6269 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3127    4.7679    0.8392 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9987    4.7681    0.8382 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2957    3.5691    0.6259 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2798    2.5875    0.4522 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.2767    5.9997    1.0549 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8905    7.0465    1.2402 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1198    5.9999    1.0538 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8180    7.1910    1.2634 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1168    7.1912    1.2623 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7441    8.2612    1.4507 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0428    8.2614    1.4496 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9941    8.5963    1.5121 S   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7838    9.5254    1.6721 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4634   10.0234    2.8629 F   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4616   10.4009    0.7241 F   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0914    9.2863    1.6287 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.0665    1.2399    0.2206 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3730    0.0571    0.0113 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3361   -1.0523   -0.1837 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8885   -2.2991   -0.4042 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7611   -3.3046   -0.5798 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0814   -3.0634   -0.5349 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5291   -1.8166   -0.3145 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4634   -0.0468   -0.0082 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0445   -4.1730   -0.7287 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8541   -5.0945    0.2113 F   0  0  0  0  0  0  0  0  0  0  0  0
    9.8579   -4.7176   -1.9276 F   0  0  0  0  0  0  0  0  0  0  0  0
   11.2857   -3.7027   -0.6436 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.4314   -2.5654   -0.4537 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8791   -2.2263    0.7077 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.8829   -1.8495   -1.4312 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.2247   -3.8592   -0.6820 F   0  0  0  0  0  0  0  0  0  0  0  0
   10.1580    4.5252    0.8052 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8460    5.1193    1.7946 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8490    5.4222    0.0738 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5331    1.5106    0.2662 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8937    4.4161    0.7794 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4384    3.5353    0.6278 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8287    5.6479    0.9950 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6120    5.1603    0.9052 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7586    0.1532   -0.8595 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7571   -0.1505    0.8612 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4171   -4.2627   -0.7492 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4983   -1.4679   -0.2513 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6719    0.6056    0.1054 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 41  1  0  0  0  0
  1 42  1  0  0  0  0
  1 43  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 25  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5 44  1  0  0  0  0
  6  7  1  0  0  0  0
  6 45  1  0  0  0  0
  7  9  1  0  0  0  0
  7  8  2  0  0  0  0
  8 46  1  0  0  0  0
  9 10  2  0  0  0  0
  9 47  1  0  0  0  0
 10 13  1  0  0  0  0
 10 11  1  0  0  0  0
 11 12  3  0  0  0  0
 13 15  1  0  0  0  0
 13 14  2  0  0  0  0
 15 16  1  0  0  0  0
 15 48  1  0  0  0  0
 16 17  2  0  0  0  0
 16 20  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 21  1  0  0  0  0
 19 20  1  0  0  0  0
 21 24  1  0  0  0  0
 21 23  1  0  0  0  0
 21 22  1  0  0  0  0
 25 26  1  0  0  0  0
 26 27  1  0  0  0  0
 26 49  1  0  0  0  0
 26 50  1  0  0  0  0
 27 28  2  0  0  0  0
 27 32  1  0  0  0  0
 28 37  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  2  0  0  0  0
 29 51  1  0  0  0  0
 30 33  1  0  0  0  0
 30 31  1  0  0  0  0
 31 32  2  0  0  0  0
 31 52  1  0  0  0  0
 32 53  1  0  0  0  0
 33 36  1  0  0  0  0
 33 35  1  0  0  0  0
 33 34  1  0  0  0  0
 37 40  1  0  0  0  0
 37 39  1  0  0  0  0
 37 38  1  0  0  0  0
M  END
>  <SKU>
A13299

>  <Product Name>
XCT 790

>  <CAS>
725247-18-7

>  <M.Wt>
596.4249488

>  <Formula>
C23H13F9N4O3S

>  <Synonyms>
XCT790, XCT-790

>  <URL>
https://www.adooq.com/xct-790.html

$$$$
