
 OpenBabel04291915353D

 39 42  0  0  0  0  0  0  0  0999 V2000
    0.9696    0.0439   -0.0846 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4896    0.0439   -0.0846 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9963   -1.3877   -0.0204 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9678    0.6670   -1.2849 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2447    0.7764   -1.4955 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6923    1.3597   -2.6193 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8196    1.8300   -3.5252 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5277    1.7194   -3.3121 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5893    2.2251   -4.2862 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2974    2.1144   -4.0731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5752    2.5847   -4.9790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8956    2.4716   -4.7612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3432    1.8883   -3.6375 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4705    1.4180   -2.7316 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1502    1.5311   -2.9494 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0622    1.1127   -2.1435 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7722    2.9441   -5.6713 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1525    1.1064   -2.1312 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0126    1.4728   -2.8371 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8566    1.0180   -1.9609 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4237    0.4538   -0.8742 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0886    0.3216   -0.6194 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4781    2.0794   -4.0056 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6129    1.0517   -0.1297 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6129   -0.4209    0.8108 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6129   -0.4991   -0.9348 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8463    0.5869    0.7656 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6396   -1.9307   -0.8706 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6396   -1.8525    0.8749 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0663   -1.3877   -0.0204 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9333    2.6733   -5.1498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2313    3.0330   -5.8426 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3578    1.8014   -3.4701 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8145    0.9697   -1.8680 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4599    3.3511   -6.4553 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1694    1.1308   -2.1783 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1052    0.0968   -0.1864 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8383    2.4242   -4.6698 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4460    2.1623   -4.1653 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 24  1  0  0  0  0
  1 25  1  0  0  0  0
  1 26  1  0  0  0  0
  2  4  1  0  0  0  0
  2  3  1  0  0  0  0
  2 27  1  0  0  0  0
  3 28  1  0  0  0  0
  3 29  1  0  0  0  0
  3 30  1  0  0  0  0
  4  5  1  0  0  0  0
  4 18  1  0  0  0  0
  5  6  2  0  0  0  0
  5 22  1  0  0  0  0
  6 19  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7 18  1  0  0  0  0
  8  9  1  0  0  0  0
  8 16  1  0  0  0  0
  9 10  2  0  0  0  0
  9 31  1  0  0  0  0
 10 11  1  0  0  0  0
 10 15  1  0  0  0  0
 11 12  2  0  0  0  0
 11 32  1  0  0  0  0
 12 17  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 13 33  1  0  0  0  0
 14 15  1  0  0  0  0
 14 34  1  0  0  0  0
 15 16  2  0  0  0  0
 17 35  1  0  0  0  0
 18 36  1  0  0  0  0
 19 23  1  0  0  0  0
 19 20  2  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 21 37  1  0  0  0  0
 23 38  1  0  0  0  0
 23 39  1  0  0  0  0
M  END
>  <SKU>
A10746

>  <Product Name>
PP242 (Torkinib)

>  <CAS>
1092351-67-1

>  <M.Wt>
308.33784

>  <Formula>
C16H16N6O

>  <Synonyms>
PP-242

>  <URL>
https://www.adooq.com/pp242.html

$$$$
