Molecule Editor

Molecule ID: FYI-1003957 Edit

Molecule Structure InChIKey: KFYUNDYSXDFUMD-UHFFFAOYSA-N

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

Download SDF Download SVG Structure in 2D SDF:

FYI-1003957
FYIcenter.com

 43 47  0  0  0  0  0  0  0  0999 V2000
    3.6374    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6374    7.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   18.2001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   16.8001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498   16.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.4248   16.1001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   16.8001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   18.2001    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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  1 27  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003957-3D
FYIcenter.com

 86 90  0  0  1  0  0  0  0  0999 V2000
    7.1395    0.3966    0.0152 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9953    1.5848    0.4548 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0764    2.7084    0.8663 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6563    2.6230    2.1596 N   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8493    4.0931    1.5026 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$