Molecule Editor

Molecule ID: FYI-1003913 Edit

Molecule Structure InChIKey: GLLNBAKMDNNQJJ-UHFFFAOYSA-N

Molecule Structure SMILES String: CCc4nc(C(N)=O)c(Nc3ccc(N2CCC(N1CCN(C)C(C#N)C1)CC2)c(OC)c3)nc4NC5CCOCC5

Download SDF Download SVG Structure in 2D SDF:

FYI-1003913
FYIcenter.com

 42 46  0  0  0  0  0  0  0  0999 V2000
    1.2124   18.2002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   16.8002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248   16.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248   14.7001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374   14.0001    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8498   16.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374   16.8002    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   16.8002    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   16.1001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   18.2002    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    9.8001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4249    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  8  3  1  0  0  0  0
  9  7  1  0  0  0  0
 10  9  2  0  0  0  0
 11  9  1  0  0  0  0
 12  6  1  0  0  0  0
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 14 13  2  0  0  0  0
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 33 32  1  0  0  0  0
 34  4  1  0  0  0  0
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 38 37  1  0  0  0  0
 39 38  1  0  0  0  0
 40 39  1  0  0  0  0
 40 35  1  0  0  0  0
 27 41  1  0  0  0  0
 41 42  3  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003913-3D
FYIcenter.com

 85 89  0  0  1  0  0  0  0  0999 V2000
    1.2964    0.2637   -0.3141 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8081    0.0945   -0.1863 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5270    1.3107   -0.7074 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1607    1.1136   -1.9038 N   0  0  0  0  0  0  0  0  0  0  0  0
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    5.3240    0.8233   -4.3670 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3542    3.0534   -4.6654 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.8872    9.9705   -2.7631 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2025   10.6491   -4.0167 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.3628   13.2569   -5.3622 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0820   14.6002   -5.6010 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$