Molecule Editor

Molecule ID: FYI-1006290 Edit

Molecule Structure InChIKey: LRGPIURPNNEALP-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C4CCC(n3c(=O)c2ccc(CNC(=O)Nc1cccc(Cl)c1)cc2c3=O)C(=O)N4

Download SDF Download SVG Structure in 2D SDF:

FYI-1006290
FYIcenter.com

 31 34  0  0  0  0  0  0  0  0999 V2000
   15.3953    8.4655    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   14.1829    9.1655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1829   10.5655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9705   11.2655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.9083    9.1655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    2.4249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2000    2.4249    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1924    4.9962    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1292    3.9557    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4835    6.3655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6959    7.0655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.9705    8.4655    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  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  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
 10  8  1  0  0  0  0
 11 10  1  0  0  0  0
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 21 20  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  2  0  0  0  0
 24 22  1  0  0  0  0
 25 24  1  0  0  0  0
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 29 15  1  0  0  0  0
 30 29  2  0  0  0  0
 30 12  1  0  0  0  0
 31  6  2  0  0  0  0
 31  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006290-3D
FYIcenter.com

 48 51  0     1  0  0  0  0  0999 V2000
    8.6345    2.2199    1.8617 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.4872    2.3078    0.7228 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1384    0.0141   -2.3615 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7507   -0.8491    1.8952 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.3322   -0.7715   -1.5678 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3023   -0.1982   -0.3245 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7833    2.2671    0.5805 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0825   -2.3267    0.1249 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.2904   -1.2189   -0.5236 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2726   -0.3895   -1.2213 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0753   -1.7080   -0.9569 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$