Molecule Editor

Molecule ID: FYI-1004272 Edit

Molecule Structure InChIKey: QIHUEGAGTWCAOJ-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C(CN(C(=O)Cc1ccc(C(=O)NO)cc1)c2ccccc2C(F)(F)F)NC3CCCCC3

Download SDF Download SVG Structure in 2D SDF:

FYI-1004272
FYIcenter.com

 34 36  0  0  0  0  0  0  0  0999 V2000
    6.0622    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   10.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119   11.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9125    4.0124    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.5000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.5125    1.5876    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11  8  2  0  0  0  0
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 13  4  1  0  0  0  0
 14  2  1  0  0  0  0
 15 14  1  0  0  0  0
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 25 14  1  0  0  0  0
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 31 30  1  0  0  0  0
 32 31  1  0  0  0  0
 33 31  1  0  0  0  0
 34 31  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004272-3D
FYIcenter.com

 60 62  0  0  0  0  0  0  0  0999 V2000
    3.1876   -0.8837    0.9629 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8309   -0.9911   -0.2105 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7378    0.2648   -1.1138 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8882    0.2607   -2.3278 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4776    0.2612   -2.2909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1887    0.4076   -3.3173 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1628    0.0310   -0.9326 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6753   -0.0134   -0.8517 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2505   -0.8909    0.0824 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6315   -0.9497    0.2598 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -5.9426   -0.1808   -0.3476 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6472    0.7988   -0.5717 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4670   -1.3993    0.0151 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8784   -1.4754   -0.0149 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4975    0.7883   -3.5184 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3875   -0.0583   -4.1956 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8574    0.2716   -5.4697 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4512    1.4522   -6.0816 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$