
 OpenBabel04291915353D

 78 79  0  0  0  0  0  0  0  0999 V2000
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    3.1467    0.1882    0.6943 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.2782    1.1545   -0.4716 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2428    0.4672    1.7097 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5246    0.2959    1.0889 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6098    0.4848    1.7769 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8098    0.3244    1.1957 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8876   -0.0314   -0.0969 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7655   -0.2267   -0.8083 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8433   -0.5825   -2.1009 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5345    0.8289    3.0270 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6368   -0.7926   -2.8658 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7146   -1.1483   -4.1584 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4689   -1.1800   -4.2849 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.0199   -1.1490   -4.1846 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0049   -1.3220   -4.7830 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0827   -1.6778   -6.0756 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2827   -1.8392   -6.6565 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3605   -2.1950   -7.9491 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2384   -2.3893   -8.6608 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.5150   -2.3504   -8.5080 F   0  0  0  0  0  0  0  0  0  0  0  0
    8.8950    0.5133    1.8837 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5999   -0.0482   -0.1612 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4330   -0.2514   -0.9010 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9597    0.0243    0.0882 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7697    0.0243    0.0882 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.2784   -1.3681   -0.2741 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2784    1.0343   -0.9365 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3397    0.4529    1.6424 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9597    0.0243    0.0882 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3397    0.4529    1.6424 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6966    1.3742    1.7093 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6959   -0.3105    2.1729 H   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2334   -1.3665   -0.2760 H   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1863    2.1589   -0.1145 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5066    0.9580   -1.1864 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2343    1.0267   -0.9347 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1502   -0.2130    2.5305 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1509    1.4717    2.0669 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8098   -0.1547   -0.5435 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8434   -0.1035   -0.3616 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5420   -0.4612   -1.6519 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2246    0.5756   -5.8817 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3084   -0.5853   -6.8123 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0547   -0.6032   -6.8688 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2189   -3.5023   -4.7597 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0514   -2.9964   -6.2103 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3051   -2.9785   -6.1538 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0397   -1.8276   -3.3575 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1258   -1.3038   -4.7517 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0420   -0.1429   -3.8211 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2204   -1.8270   -6.6226 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1450   -1.6899   -6.1096 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6669   -2.6165   -9.4895 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6985   -0.9005   -3.2426 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5533   -0.1338   -0.4749 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4901   -0.5122   -1.8486 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6030    1.0006    0.3422 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6030   -0.6838    0.8067 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6030   -0.2438   -0.8843 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0163    1.3380    1.8727 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6030    1.0006    0.3422 H   0  0  0  0  0  0  0  0  0  0  0  0
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    0.6030   -0.2438   -0.8843 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0163    1.3380    1.8727 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
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  5  6  1  0  0  0  0
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  6  7  1  0  0  0  0
  6 30  1  0  0  0  0
  7  8  2  0  0  0  0
  7 12  1  0  0  0  0
  8 29  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 53  1  0  0  0  0
 10 11  1  0  0  0  0
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 14 22  1  0  0  0  0
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 41 78  1  0  0  0  0
M  END
>  <SKU>
A10545

>  <Product Name>
LY2228820 (Ralimetinib)

>  <CAS>
862507-23-1

>  <M.Wt>
612.7369832

>  <Formula>
C26H37FN6O6S2

>  <Synonyms>
LY-2228820

>  <URL>
https://www.adooq.com/ly2228820.html

$$$$
