Molecule Editor

Molecule ID: FYI-1007271 Edit

Molecule Structure InChIKey: DMLAVOWQYNRWNQ-YPKPFQOOSA-N

Molecule Structure SMILES String: c2ccc(/N=N\c1ccccc1)cc2

Download SDF Download SVG Structure in 2D SDF:

FYI-1007271
FYIcenter.com

 14 15  0  0  0  0  0  0  0  0999 V2000
    3.6373    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    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 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    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
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.8000    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  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  8  3  1  0  0  0  0
  9  1  1  0  0  0  0
 10  9  2  0  0  0  0
 11 10  1  0  0  0  0
 12 11  2  0  0  0  0
 13 12  1  0  0  0  0
 14 13  2  0  0  0  0
 14  9  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007271-3D
FYIcenter.com

 24 25  0  0  0  0  0  0  0  0999 V2000
    1.4698   -0.2298    0.1125 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9835    0.4208   -1.0186 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3920    0.6249   -1.1680 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2979    0.1780   -0.1961 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6752    0.3934   -0.4105 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5271   -0.5339   -0.3807 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1843   -1.8799   -0.1529 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8219   -2.5713    0.8866 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4956   -3.8993    1.1758 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5215   -4.5531    0.4242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9122   -3.8966   -0.6421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2708   -2.5813   -0.9502 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7826   -0.4064    0.9683 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5869   -0.6402    1.1080 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5360   -0.4098    0.2221 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6714    0.7668   -1.7859 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7630    1.1275   -2.0575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5770   -2.0646    1.4837 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9932   -4.4190    1.9905 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2405   -5.5751    0.6651 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1499   -4.4003   -1.2322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7950   -2.0841   -1.7917 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4608   -0.7240    1.7552 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9594   -1.1495    1.9926 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  2  0  0  0  0
  1 15  1  0  0  0  0
  2  3  2  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3 17  1  0  0  0  0
  4  5  1  0  0  0  0
  4 13  2  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 12  2  0  0  0  0
  8  9  2  0  0  0  0
  8 18  1  0  0  0  0
  9 10  1  0  0  0  0
  9 19  1  0  0  0  0
 10 11  2  0  0  0  0
 10 20  1  0  0  0  0
 11 12  1  0  0  0  0
 11 21  1  0  0  0  0
 12 22  1  0  0  0  0
 13 14  1  0  0  0  0
 13 23  1  0  0  0  0
 14 24  1  0  0  0  0
M  END
$$$$