
 OpenBabel04291915373D

 54 57  0  0  1  0  0  0  0  0999 V2000
   -5.4132    4.8920   18.1754 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1447    6.2005   17.4501 C   0  0  3  0  0  0  0  0  0  0  0  0
   -4.2726    5.9358   16.2336 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9545    5.3235   16.6786 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1315    5.0737   15.5306 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6107    5.4031   14.2192 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4301    7.1614   18.3863 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8639    4.5098   15.6896 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4538    4.2279   16.8118 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0627    4.2666   14.5719 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2050    3.7027   14.7309 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9501    3.4765   13.6915 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1290    2.9521   13.8393 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8995    2.7182   12.7646 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4509    3.0266   11.5369 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2319    3.5689   11.3840 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7834    3.8773   10.1564 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5776    2.6437   15.0670 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7554    3.3242   16.2374 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.9795    5.0038    9.9693 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5004    5.3332    8.6579 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3450    6.5944    8.7294 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8193    6.9205    7.4312 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6090    8.0988    7.4980 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6330    5.8315   11.0884 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1240    2.1735   12.9181 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9198    1.9319   11.8081 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3761    6.7726   17.0343 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9162    4.2156   17.5163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0271    5.0783   19.0317 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4853    4.4609   18.4887 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0836    6.8569   15.7230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7756    5.2594   15.5745 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1435    4.4024   17.1892 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4515    5.9999   17.3377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1582    4.6889   13.6404 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2038    5.7993   13.3123 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0555    6.8296   19.3320 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6169    8.1220   18.8190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3915    4.4927   13.6719 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0430    2.8469   10.7110 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6398    3.7486   12.2100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0937    4.5265    8.2821 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3321    5.4978    8.0052 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2491    7.4012    9.1051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1767    6.4298    9.3821 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6734    8.0604    7.3957 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6296    9.0735    7.0571 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4358    6.3591   11.5597 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1901    5.5041   12.0058 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8477    1.5009   12.1214 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1088    2.8531   11.2975 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4168    1.2555   11.1490 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8320    6.1594   16.4368 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 29  1  0  0  0  0
  1 30  1  0  0  0  0
  1 31  1  0  0  0  0
  2 28  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  3 32  1  0  0  0  0
  3 33  1  0  0  0  0
  4  5  1  0  0  0  0
  4 34  1  0  0  0  0
  4 35  1  0  0  0  0
  5  8  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 36  1  0  0  0  0
  6 37  1  0  0  0  0
  7 38  1  0  0  0  0
  7 39  1  0  0  0  0
  8 10  1  0  0  0  0
  8  9  2  0  0  0  0
 10 11  1  0  0  0  0
 10 40  1  0  0  0  0
 11 12  2  0  0  0  0
 11 19  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 18  1  0  0  0  0
 14 26  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 41  1  0  0  0  0
 16 17  1  0  0  0  0
 16 42  1  0  0  0  0
 17 20  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 20 21  1  0  0  0  0
 20 25  1  0  0  0  0
 21 22  1  0  0  0  0
 21 43  1  0  0  0  0
 21 44  1  0  0  0  0
 22 23  1  0  0  0  0
 22 45  1  0  0  0  0
 22 46  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 47  1  0  0  0  0
 24 48  1  0  0  0  0
 25 49  1  0  0  0  0
 25 50  1  0  0  0  0
 26 27  1  0  0  0  0
 27 51  1  0  0  0  0
 27 52  1  0  0  0  0
 27 53  1  0  0  0  0
 28 54  1  0  0  0  0
M  END
>  <SKU>
A11560

>  <Product Name>
SYN-115 (Tozadenant)

>  <CAS>
870070-55-6

>  <M.Wt>
406.49914

>  <Formula>
C19H26N4O4S

>  <Synonyms>
SYN115, Tozadenant

>  <URL>
https://www.adooq.com/syn-115.html

$$$$
