
 OpenBabel04291915373D

 51 54  0  0  0  0  0  0  0  0999 V2000
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   14.0669   -2.7315   -1.2997 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9396   -1.8115   -0.8576 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.3638   -1.7732   -0.8466 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.7335   -1.7881   -2.2363 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.7310   -2.8656    0.0107 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0825   -0.1609   -0.0738 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2168   -7.0026   -3.3473 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.5112   -7.4530   -3.5605 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7150   -6.4115   -3.0712 H   0  0  0  0  0  0  0  0  0  0  0  0
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   12.4026   -1.6322   -0.7744 H   0  0  0  0  0  0  0  0  0  0  0  0
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    7.0305    0.0159    0.0098 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5262    0.6051   -0.6749 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.4815   -8.4173   -4.0232 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0235   -7.5225   -2.6238 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.0270   -6.7667   -4.1992 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 33  1  0  0  0  0
  1 34  1  0  0  0  0
  1 35  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 31  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5 36  1  0  0  0  0
  6  7  1  0  0  0  0
  6 11  1  0  0  0  0
  7  9  1  0  0  0  0
  7  8  2  0  0  0  0
  8 37  1  0  0  0  0
  9 10  2  0  0  0  0
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 10 38  1  0  0  0  0
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 12 13  2  0  0  0  0
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 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
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 21 22  2  0  0  0  0
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 23 24  2  0  0  0  0
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 27 30  1  0  0  0  0
 27 29  2  0  0  0  0
 27 28  2  0  0  0  0
 30 46  1  0  0  0  0
 30 47  1  0  0  0  0
 30 48  1  0  0  0  0
 31 32  1  0  0  0  0
 32 49  1  0  0  0  0
 32 50  1  0  0  0  0
 32 51  1  0  0  0  0
M  END
>  <SKU>
A11463

>  <Product Name>
IKK-3 Inhibitor

>  <CAS>
862812-98-4

>  <M.Wt>
469.53336

>  <Formula>
C22H19N3O5S2

>  <Synonyms>
CAY10576

>  <URL>
https://www.adooq.com/ikk-3-inhibitor.html

$$$$
