
 OpenBabel04291915423D

 34 37  0  0  0  0  0  0  0  0999 V2000
    8.0785    1.6113    1.7941 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8963    0.9729    1.0834 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3586    0.0977    0.1118 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4820   -0.5878   -0.6508 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9297   -1.4352   -1.5915 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6162    2.4866    2.7657 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0570   -2.1175   -2.3506 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5046   -2.9650   -3.2913 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6319   -3.6473   -4.0505 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1617   -0.4227   -0.4692 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0974   -4.5286   -5.0287 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2535   -5.1885   -5.7629 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0466   -5.0376   -5.5969 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6864   -6.0080   -6.6726 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8711   -6.6455   -7.3818 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.3743   -4.6882   -5.2043 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5258   -3.7878   -4.2026 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.1795   -4.2150   -4.6748 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1896   -3.6695   -4.0675 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.4016   -3.9825   -4.4136 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4461   -3.4185   -3.7856 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4356   -5.3043   -5.8845 S   0  0  0  0  0  0  0  0  0  0  0  0
   14.7494   -3.7551   -4.1578 N   0  3  0  0  0  0  0  0  0  0  0  0
   14.9335   -4.5380   -5.0272 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617   -3.2085   -3.5492 O   0  5  0  0  0  0  0  0  0  0  0  0
    8.6738    2.1477    1.0850 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6722    0.8491    2.2541 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3027    1.7351    0.6234 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3011    0.4365    1.7925 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0424   -1.9907   -2.2111 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5192   -3.0918   -3.4309 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4642    0.0867    0.0956 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6543   -6.1290   -6.8057 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.5620   -4.6647   -5.1711 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  1  0  0  0  0
  1 26  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
  2 29  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  7  1  0  0  0  0
  5  6  1  0  0  0  0
  7  8  2  0  0  0  0
  7 30  1  0  0  0  0
  8  9  1  0  0  0  0
  8 31  1  0  0  0  0
  9 11  1  0  0  0  0
  9 10  2  0  0  0  0
 10 32  1  0  0  0  0
 11 12  1  0  0  0  0
 11 16  1  0  0  0  0
 12 14  1  0  0  0  0
 12 13  2  0  0  0  0
 14 15  1  0  0  0  0
 14 33  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 18 22  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 20 34  1  0  0  0  0
 21 23  1  0  0  0  0
 21 22  1  0  0  0  0
 23 25  1  0  0  0  0
 23 24  2  0  0  0  0
M  CHG  2  23   1  25  -1
M  END
>  <SKU>
A13683

>  <Product Name>
BI-78D3

>  <CAS>
883065-90-5

>  <M.Wt>
379.37106

>  <Formula>
C13H9N5O5S2

>  <Synonyms>
BI 78D3, BI78D3

>  <URL>
https://www.adooq.com/bi-78d3.html

$$$$
