Molecule Editor

Molecule ID: FYI-1014790 Edit

Molecule Structure InChIKey: FLWRVCXDARLFGF-UHFFFAOYSA-O

Molecule Structure SMILES String: CCCCCCCCCCCCCCCC(=O)Nc2cc(c1ncc[s+]1C(=O)NO)c(O)cc2CCCC

Download SDF Download SVG Structure in 2D SDF:

FYI-1014790
FYIcenter.com

 38 39  0  0  0  0  0  0  0  0999 V2000
   16.7650   19.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5526   18.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5526   17.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3402   16.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3402   15.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1278   14.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1278   13.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9153   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9153   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7029   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7029    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.2158    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2158    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9369    2.2306    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.2710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7000    4.4834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0695    4.1923    0.0000 S   0  3  0  0  0  0  0  0  0  0  0  0
    3.1098    5.1292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4414    4.6964    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8188    6.4985    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8592    7.4353    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  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
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 17 16  2  0  0  0  0
 18 16  1  0  0  0  0
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 37 35  1  0  0  0  0
 38 37  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014790-3D
FYIcenter.com

 86 87  0  0  0  0  0  0  0  0999 V2000
    1.0369   -0.2831    0.0519 C   0  0  0  0  0  0  0  0  0  0  0  0
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   19.1738   -2.2009    8.4663 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$