Molecule Editor

Molecule ID: FYI-1000980 Edit

Molecule Structure SMILES String: S=C1S/C(=C/c2ccccc2C)C(=O)N1CCN(CC)CC

Download SDF Download SVG Structure in 2D SDF:

FYI-1000980
FYIcenter.com

 22 23  0  0  0  0  0  0  0  0999 V2000
    7.6322    0.8611    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.3412    2.2306    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2779    3.2710    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    7.5779    4.4834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1473    5.7624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3245    6.8950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9321    6.7487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1092    7.8813    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6787    9.1602    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0710    9.3066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8939    8.1739    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2862    8.3203    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2086    4.1923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1681    5.1292    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    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  2  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 11  6  1  0  0  0  0
 12 11  1  0  0  0  0
 13  4  1  0  0  0  0
 14 13  2  0  0  0  0
 15 13  1  0  0  0  0
 15  2  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  1  0  0  0  0
 21 18  1  0  0  0  0
 22 21  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1000980-3D
FYIcenter.com

 44 45  0  0  0  0  0  0  0  0999 V2000
    2.6236    0.2915    0.1770 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.9593    0.1758    0.1299 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0621    1.6134    0.0785 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5136    0.6914    0.0184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7397    1.2272    0.0853 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9704    0.4273    0.1262 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6012    0.1045   -1.0841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7172   -0.7322   -1.0980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2109   -1.2514    0.0952 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5969   -0.9273    1.3055 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4772   -0.0815    1.3389 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8328    0.2304    2.6624 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1806   -0.7559   -0.0813 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9922   -1.6327   -0.3575 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1783   -0.9588    0.0880 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6796   -2.3337   -0.0097 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3223   -2.9164    1.2675 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5475   -2.9346    2.5323 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7689   -3.5857    2.4180 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7736   -5.0901    2.1576 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4053   -3.5272    3.5827 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8093   -3.5591    4.9855 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4232   -2.3532   -0.8141 H   0  0  0  0  0  0  0  0  0  0  0  0
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    1.6466   -3.9350    1.0199 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.5739   -5.6517    3.0753 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3271   -2.9356    3.6478 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.0455   -4.2374    5.0541 H   0  0  0  0  0  0  0  0  0  0  0  0
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 11 12  1  0  0  0  0
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 17 33  1  0  0  0  0
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 22 44  1  0  0  0  0
M  END
$$$$