Molecule Editor

Molecule ID: FYI-1004632 Edit

Molecule Structure InChIKey: ZZVXFMDUKBNKQP-CRKCGEKBSA-N

Molecule Structure SMILES String: Cc3cc(C(C)/C(N)=N/OC(=O)N/C(=C/CN)CC2=CN(c1cncnc1N)COC2)no3

Download SDF Download SVG Structure in 2D SDF:

FYI-1004632
FYIcenter.com

 33 35  0  0  0  0  0  0  0  0999 V2000
    8.4578    5.8834    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.2454    6.5834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2454    7.9834    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4578    8.6834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4578   10.0834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2454   10.7834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    1.3587    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3290    2.2527    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
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 33 31  2  0  0  0  0
 33 28  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004632-3D
FYIcenter.com

 60 62  0  0  1  0  0  0  0  0999 V2000
    2.4747    0.0590    3.9274 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5716   -1.0155    3.4830 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4463   -1.5882    4.0143 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0365   -2.5430    3.0491 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1555   -3.4567    3.1229 C   0  0  3  0  0  0  0  0  0  0  0  0
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   -1.6404   -4.0130    1.7721 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4696   -3.2923    0.6107 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2439   -5.1620    1.8317 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.7736   -8.4895    0.1815 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$