
 OpenBabel04291915433D

 44 46  0  0  0  0  0  0  0  0999 V2000
   -3.2041    5.5019   -4.6090 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8976    6.4230   -5.3800 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2466    6.4237   -5.3791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9180    7.3155   -6.1257 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2610    7.3162   -6.1248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9324    8.2079   -6.8714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2753    8.2087   -6.8705 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9180    5.5327   -4.6317 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1960    4.5738   -3.8290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8675    3.6827   -3.0816 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1960    2.7910   -2.3350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8973    2.7903   -2.3359 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2479    3.6520   -3.0587 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8973    4.5731   -3.8298 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8943    1.8644   -1.5578 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1960    0.9370   -0.7815 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8675    0.0460   -0.0340 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1961   -0.8458    0.7125 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8675   -1.7368    1.4599 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1961   -2.6286    2.2065 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8531    0.9363   -0.7823 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9371   -3.6119    3.0313 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7609   -4.6670    3.9141 S   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8845   -5.4058    2.9066 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8825   -3.8052    4.8167 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6409   -5.8348    4.8937 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1521    5.6512   -4.7352 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4633    4.5109   -4.9180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4618    5.6332   -3.5788 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4020    8.0002   -6.7001 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7770    6.6314   -5.5505 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4164    8.8927   -7.4458 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2249    8.5189   -7.1294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8995    3.6833   -3.0809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2160    3.6404   -3.0501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8788    1.8649   -1.5572 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8995    0.0466   -0.0334 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1641   -0.8463    0.7118 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8995   -1.7362    1.4606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0284    1.4113   -1.1813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5529   -4.2161    2.3985 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5515   -3.0939    3.7377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2266   -5.3409    5.5671 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9780   -6.4293    5.3912 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 27  1  0  0  0  0
  1 28  1  0  0  0  0
  1 29  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 30  1  0  0  0  0
  5  6  2  0  0  0  0
  5 31  1  0  0  0  0
  6  7  1  0  0  0  0
  6 32  1  0  0  0  0
  7  8  2  0  0  0  0
  7 33  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 14  1  0  0  0  0
 10 11  1  0  0  0  0
 10 34  1  0  0  0  0
 11 15  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 35  1  0  0  0  0
 15 16  1  0  0  0  0
 15 36  1  0  0  0  0
 16 17  2  0  0  0  0
 16 21  1  0  0  0  0
 17 18  1  0  0  0  0
 17 37  1  0  0  0  0
 18 19  2  0  0  0  0
 18 38  1  0  0  0  0
 19 20  1  0  0  0  0
 19 39  1  0  0  0  0
 20 22  1  0  0  0  0
 20 21  2  0  0  0  0
 21 40  1  0  0  0  0
 22 23  1  0  0  0  0
 22 41  1  0  0  0  0
 22 42  1  0  0  0  0
 23 26  1  0  0  0  0
 23 25  2  0  0  0  0
 23 24  2  0  0  0  0
 26 43  1  0  0  0  0
 26 44  1  0  0  0  0
M  END
>  <SKU>
A14273

>  <Product Name>
LDC000067

>  <CAS>
1073485-20-7

>  <M.Wt>
370.42552

>  <Formula>
C18H18N4O3S

>  <Synonyms>
LDC067

>  <URL>
https://www.adooq.com/ldc000067.html

$$$$
