Molecule Editor

Molecule ID: FYI-1013247 Edit

Molecule Structure InChIKey: HGPJFZXXXWAZDJ-UHFFFAOYSA-N

Molecule Structure SMILES String: Cc2nc(c1ccc(Cl)cc1)sc2c5cc(c4cnc(c3ccc(F)cc3)s4)c(C#N)c(=O)[nH]5

Download SDF Download SVG Structure in 2D SDF:

FYI-1013247
FYIcenter.com

 34 38  0  0  0  0  0  0  0  0999 V2000
    6.4719   10.9992    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    5.2594    7.4992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0470    6.7992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7681    7.3686    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4769    8.7381    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   14.4666    7.8999    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.6843    8.8992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8967    9.5992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1091   10.2992    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
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 32  2  1  0  0  0  0
 33 32  1  0  0  0  0
 34 33  3  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1013247-3D
FYIcenter.com

 48 52  0  0  0  0  0  0  0  0999 V2000
   -2.2061   -0.4147    1.3403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9676   -0.1663    0.5542 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5544    1.1436    0.3690 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5691    1.1879   -0.3194 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2614    2.4359   -0.6961 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6529    2.5021   -0.8823 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2753    3.7046   -1.2380 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5143    4.8577   -1.4080 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2834    6.3318   -1.8474 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.1360    4.8206   -1.2193 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5159    3.6172   -0.8595 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1615   -0.3554   -0.8104 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1621   -1.1309   -0.0349 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -2.3951   -6.5121   -3.9361 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5941   -6.3098   -3.4216 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$