
 OpenBabel04291915403D

 37 40  0  0  0  0  0  0  0  0999 V2000
    5.9721   -0.0181   -0.1434 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7365   -0.0767   -0.6662 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5743   -0.2241   -1.9911 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3388   -0.2828   -2.5139 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2654   -0.1940   -1.7118 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1343    0.1293    1.1816 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1598   -0.4454   -3.9760 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8058   -0.4792   -4.2751 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4152   -0.6166   -5.5090 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1747   -0.6476   -5.7830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2587   -0.8000   -7.1520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5697   -0.8328   -7.4416 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9727   -0.9745   -8.7147 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2836   -1.0073   -9.0043 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6867   -1.1490  -10.2775 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6491   -0.9090   -8.1355 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0587   -0.8737   -7.8242 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9367   -0.9791   -8.7754 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2045   -0.9474   -8.4953 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6075   -0.8057   -7.2221 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8753   -0.7740   -6.9421 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8015   -0.5304   -4.7255 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6570   -0.6916   -6.1924 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8789   -0.5982   -5.3494 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8320   -0.9829   -8.7984 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7084   -1.0119   -9.0465 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7970   -0.0862   -0.7598 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9117   -0.0085   -0.0498 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3992   -0.2923   -2.6075 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2334   -0.1945   -1.7119 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6501    0.2283    2.0699 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6178   -1.3594   -4.2919 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6170    0.3772   -4.4850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2673   -0.7490   -6.6858 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2751   -1.0582   -9.4706 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9813   -0.9235   -8.2485 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3572   -1.2360  -11.0572 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 27  1  0  0  0  0
  2  3  1  0  0  0  0
  2 28  1  0  0  0  0
  3  4  2  0  0  0  0
  3 29  1  0  0  0  0
  4  7  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5 30  1  0  0  0  0
  6 31  1  0  0  0  0
  7  8  1  0  0  0  0
  7 32  1  0  0  0  0
  7 33  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  3  0  0  0
 10 11  1  0  0  0  0
 10 22  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 34  1  0  0  0  0
 13 14  2  0  0  0  0
 13 35  1  0  0  0  0
 14 15  1  0  0  0  0
 14 36  1  0  0  0  0
 15 16  2  0  0  0  0
 15 37  1  0  0  0  0
 16 17  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
 19 25  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
 23 24  3  0  0  0  0
 25 26  3  0  0  0  0
M  END
>  <SKU>
A12827

>  <Product Name>
DUBs-IN-1

>  <CAS>
924296-18-4

>  <M.Wt>
337.33424

>  <Formula>
C20H11N5O

>  <Synonyms>
N/A

>  <URL>
https://www.adooq.com/dubs-in-1.html

$$$$
