Molecule Editor

Molecule ID: FYI-1015934 Edit

Molecule Structure InChIKey: WIGIZIANZCJQQY-RUCARUNLSA-N

Molecule Structure SMILES String: CCC3=C(C)CN(C(=O)NCCc2ccc(S(=O)(=O)NC(=O)N[C@@H]1CC[C@@H](C)CC1)cc2)C3=O

Download SDF Download SVG Structure in 2D SDF:

FYI-1015934
FYIcenter.com

 34 36  0  0  1  0  0  0  0  0999 V2000
   19.7566    2.9612    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.4655    4.3306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.4023    5.3710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.7946    5.2246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   22.6176    6.3572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7023    6.5835    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.2717    7.8624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.3329    6.2923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1866    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742    2.8000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   12.1244    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6995    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.1871    0.8876    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0622    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  3  2  0  0  0  0
  7  6  1  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
  9  2  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
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 14 13  1  0  0  0  0
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 18 17  2  0  0  0  0
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 20 19  2  0  0  0  0
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 21 18  1  0  0  0  0
 22 21  2  0  0  0  0
 23 21  2  0  0  0  0
 24 21  1  0  0  0  0
 25 24  1  0  0  0  0
 26 25  2  0  0  0  0
 27 25  1  0  0  0  0
 28 27  1  6  0  0  0
 29 28  1  0  0  0  0
 30 29  1  0  0  0  0
 31 30  1  0  0  0  0
 31 32  1  1  0  0  0
 33 31  1  0  0  0  0
 34 33  1  0  0  0  0
 34 28  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015934-3D
FYIcenter.com

 68 70  0  0  1  0  0  0  0  0999 V2000
    3.6565   -0.1612   -0.3912 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1325    1.0590   -1.1631 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4618    2.2997   -0.6904 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3311    2.8929   -1.0976 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1513    4.2150    0.5755 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2302    5.2465    1.4957 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3877    6.1415    1.5459 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.9202    5.9923    4.6910 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0862    7.0994    5.7242 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2259    8.4503    5.3693 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2897    9.4593    6.3428 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1865    9.1223    7.6952 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3476   10.3797    8.9518 S   0  0  0  0  0  0  0  0  0  0  0  0
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    2.7792   10.8686    9.2727 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8440   10.0705    9.9067 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0656    8.9074   10.2040 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6451   10.6811   10.1590 N   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$