Molecule Editor

Molecule ID: FYI-1014494 Edit

Molecule Structure InChIKey: ZTJCVDYHJGXXTB-UHFFFAOYSA-N

Molecule Structure SMILES String: CN(C)c2nc(N1CCOCC1)ncc2NC(=O)c5cnc(c4ccc3OCOc3c4)s5

Download SDF Download SVG Structure in 2D SDF:

FYI-1014494
FYIcenter.com

 32 36  0  0  0  0  0  0  0  0999 V2000
   10.1091    5.4897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.6843    5.4897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8967    7.5897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6843    8.2897    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.5695    4.4810    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5319    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7443    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7847    0.9367    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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  4  2  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
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  9  8  2  0  0  0  0
  9  4  1  0  0  0  0
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 16  5  1  0  0  0  0
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 24 22  1  0  0  0  0
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 28 27  1  0  0  0  0
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 29 24  1  0  0  0  0
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 31 30  1  0  0  0  0
 32 31  1  0  0  0  0
 32 26  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014494-3D
FYIcenter.com

 54 58  0  0  0  0  0  0  0  0999 V2000
    1.6172   -0.5541   -0.8329 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3198    0.3127    0.0859 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2626    1.7571   -0.0747 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0188   -0.1571    1.1851 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0897    0.5841    1.5614 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8606    0.2035    2.5903 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9642    0.9440    2.9144 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.3380    2.1537    2.1857 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7843    2.0448    1.6739 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6996    1.6821    2.7236 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4983   -1.6053    2.9568 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6984   -1.3300    1.8710 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$