Molecule Editor

Molecule ID: FYI-1002971 Edit

Molecule Structure InChIKey: QGDQJBSZTHODHD-JMIUGGIZSA-N

Molecule Structure SMILES String: COc5cc(C2S/C(=C\c1ccoc1)C(=O)N2NC(=O)Cn4nnc3ccccc34)ccc5O

Download SDF Download SVG Structure in 2D SDF:

FYI-1002971
FYIcenter.com

 34 38  0  0  0  0  0  0  0  0999 V2000
    1.8484    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2203    0.5041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2607    1.4409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9696    2.8102    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.5977    2.3061    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000   10.9116    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9367    9.8713    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3061   10.1624    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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 34 26  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1002971-3D
FYIcenter.com

 53 57  0  0  1  0  0  0  0  0999 V2000
    7.4496    2.6937    0.2715 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5474    1.6454    0.5900 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2044    1.9191    0.5515 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6427    3.1495    0.2028 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2448    3.3481    0.2345 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6813    4.7252   -0.0133 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.9503    5.4489    1.5029 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.6933    6.2331    0.6053 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$