Molecule Editor

Molecule ID: FYI-1005852 Edit

Molecule Structure InChIKey: FUNXTYSYIXPBMM-UHFFFAOYSA-N

Molecule Structure SMILES String: CN4CCCN(C(=O)c2c[nH]n3c1ccccc1c(=O)nc23)CC4

Download SDF Download SVG Structure in 2D SDF:

FYI-1005852
FYIcenter.com

 24 27  0  0  0  0  0  0  0  0999 V2000
    9.2700    2.3814    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4813    3.5382    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1813    4.7506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6698    6.0538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3320    6.4665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1753    5.6778    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9628    6.3778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9628    7.7778    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7504    5.6778    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4715    6.2473    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5347    5.2069    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2347    3.9944    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6041    4.2855    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5409    3.2451    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3062    0.2911    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9368    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.0404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4326    2.3719    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8021    2.6630    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0707    4.2818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0970    3.3295    0.0000 C   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
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  7  6  1  0  0  0  0
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  9  7  1  0  0  0  0
 10  9  2  0  0  0  0
 11 10  1  0  0  0  0
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 13  9  1  0  0  0  0
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 21 20  1  0  0  0  0
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 22 17  1  0  0  0  0
 22 12  1  0  0  0  0
 23  6  1  0  0  0  0
 24 23  1  0  0  0  0
 24  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005852-3D
FYIcenter.com

 43 46  0     1  0  0  0  0  0999 V2000
   -1.5387    1.5666   -2.1853 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6186    2.7611    1.0595 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7549    0.0192   -0.9280 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3821   -0.5109    1.6725 N   0  0  2  0  0  0  0  0  0  0  0  0
    1.8228   -0.7967   -0.5700 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2442   -1.8159   -1.2217 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1247    1.4342   -0.0682 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0174    0.7240   -1.1538 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4782    1.4656    0.0952 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7681   -1.1942   -0.1023 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1977    0.5797    1.1146 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.3249   -0.1854   -1.2628 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1142   -1.1350    2.7816 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3520    1.6842    0.5339 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$