Molecule Editor

Molecule ID: FYI-1012442 Edit

Molecule Structure InChIKey: MAMGCESINWNGOB-WKULSOCRSA-N

Molecule Structure SMILES String: Cc4nn(Cc2nnc(SCC(O)c1ccc(Cl)cc1)n2c3ccccc3)c(=O)n4/N=C/c5ccccc5O

Download SDF Download SVG Structure in 2D SDF:

FYI-1012442
FYIcenter.com

 39 43  0  0  0  0  0  0  0  0999 V2000
   19.0689    4.1082    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.7778    2.7388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.8181    1.8019    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.5271    0.4326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1957    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.1552    0.9367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4463    2.3061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4059    3.2430    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0744    2.8102    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.0340    3.7471    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.6645    3.4560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.8841    4.0786    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.0952    2.1770    0.0000 O   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
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  5  4  2  0  0  0  0
  6  5  1  0  0  0  0
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  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
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M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1012442-3D
FYIcenter.com

 63 67  0  0  1  0  0  0  0  0999 V2000
    2.4379   -0.0808    3.3761 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.5325   -2.0375    0.1658 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2595   -3.7913   -1.0237 N   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$