untitled.cdx
csChFnd80/01281313102D

 34 37  0  0  0  0  0  0  0  0999 V2000
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    1.2082    8.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207    7.7379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    8.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6331    9.8379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4207   10.5379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   10.5355    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    7.7403    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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    4.8413    6.3452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6289    5.6452    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6289    4.2452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0538    5.6452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2662    3.5452    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7280    4.2500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6890    2.1525    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    8.5541    1.3327    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9831    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3831    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8194    1.3327    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  4  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
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 14 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 15  1  0  0  0  0
 18 20  1  0  0  0  0
 17 21  1  0  0  0  0
 20 22  1  0  0  0  0
 22 23  1  0  0  0  0
 22 24  2  0  0  0  0
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 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 30 31  1  0  0  0  0
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 34 30  1  0  0  0  0
 30 21  1  6  0  0  0
M  END
>  <Mol_ID> (1)
10

>  <Formula> (1)
C24H25ClFN5O3

>  <MolWeight> (1)
485.9384032

>  <Item Name> (1)
Afatinib (BIBW2992)

>  <Catalog Number> (1)
S1011

>  <Synonyms> (1)
Tomtovok 

>  <Target> (1)
EGFR, HER2

>  <URL> (1)
http://www.selleckchem.com/products/BIBW2992.html

>  <CAS Number> (1)
439081-18-2, 936631-70-8 (Maleic acid), 1254955-21-9 (XHCl)

$$$$
