Molecule Editor

Molecule ID: FYI-1003574 Edit

Molecule Structure InChIKey: UKWQQLFXHINMHP-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(=O)NC(CCC(N)=O)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(CCCNC(=N)N)C(=O)CF

Download SDF Download SVG Structure in 2D SDF:

FYI-1003574
FYIcenter.com

 41 40  0  0  0  0  0  0  0  0999 V2000
   14.5492    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    5.6000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    5.6000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0621    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0621    5.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    6.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    7.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249   11.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   12.6000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   11.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124   14.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    7.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    9.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747   10.5000    0.0000 F   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
  4  2  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  1  0  0  0  0
 10  8  2  0  0  0  0
 11  5  1  0  0  0  0
 12 11  2  0  0  0  0
 13 11  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 16  1  0  0  0  0
 19 14  1  0  0  0  0
 20 19  2  0  0  0  0
 21 19  1  0  0  0  0
 22 21  1  0  0  0  0
 23 22  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  1  0  0  0  0
 26 24  1  0  0  0  0
 27 22  1  0  0  0  0
 28 27  2  0  0  0  0
 29 27  1  0  0  0  0
 30 29  1  0  0  0  0
 31 30  1  0  0  0  0
 32 31  1  0  0  0  0
 33 32  1  0  0  0  0
 34 33  1  0  0  0  0
 35 34  1  0  0  0  0
 36 35  2  0  0  0  0
 37 35  1  0  0  0  0
 38 30  1  0  0  0  0
 39 38  2  0  0  0  0
 40 38  1  0  0  0  0
 41 40  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003574-3D
FYIcenter.com

 88 87  0  0  1  0  0  0  0  0999 V2000
    1.2465   -0.4970   -2.8190 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7506   -0.4153   -2.7183 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4000    0.4604   -3.2820 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3356   -1.4072   -1.9781 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7749   -1.4059   -1.6998 C   0  0  3  0  0  0  0  0  0  0  0  0
    5.0531   -0.5586   -0.4470 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5282   -0.4566   -0.0744 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7461    0.3958    1.1560 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0501    0.4797    1.5453 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8628    0.9715    1.7781 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2465   -2.8743   -1.5301 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5172   -3.7425   -1.0522 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5509   -3.1132   -1.9047 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2147   -4.4298   -1.7572 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.8693   -5.3381   -2.9588 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4398   -6.7755   -2.9405 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9864   -7.6003   -1.7315 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1069   -7.5180   -4.2333 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7531   -4.2041   -1.6174 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2738   -3.1032   -1.7927 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.4739   -5.3249   -1.2706 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9189   -5.4129   -1.0789 C   0  0  3  0  0  0  0  0  0  0  0  0
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   13.2071   -8.4940   -0.4060 C   0  0  3  0  0  0  0  0  0  0  0  0
   13.6255   -9.2875   -1.6597 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1091  -10.7157   -1.3712 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4677  -11.4846   -2.6418 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$