Molecule Editor

Molecule ID: FYI-1014424 Edit

Molecule Structure InChIKey: YLJUTUJDUAAQON-CCEZHUSRSA-N

Molecule Structure SMILES String: Nc2nc(/N=N/c1ccccc1)c(N)[nH]2

Download SDF Download SVG Structure in 2D SDF:

FYI-1014424
FYIcenter.com

 15 16  0  0  0  0  0  0  0  0999 V2000
    9.6995    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    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
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    0.0000    0.0000 C   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
    6.4814    4.1358    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  3  2  0  0  0  0
  6  5  1  0  0  0  0
  7  5  1  0  0  0  0
  7  2  1  0  0  0  0
  4  8  2  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
  8  9  1  0  0  0  0
  3 15  1  0  0  0  0
 15  2  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014424-3D
FYIcenter.com

 25 26  0  0  0  0  0  0  0  0999 V2000
    3.1061   -2.3223   -0.3103 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4554   -1.0474   -0.1404 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6668   -0.5607   -0.1488 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5214    0.7968    0.0458 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5773    1.7310    0.1042 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.6878    1.1855   -0.0914 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.7890    2.0598    0.0220 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8042    3.1956    0.8445 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9536    3.9844    0.9621 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1109    3.6416    0.2660 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1182    2.5148   -0.5522 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9640    1.7329   -0.6713 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1790    1.1267    0.1874 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4929    2.2694    0.3978 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5219   -0.0709    0.0661 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8466   -3.0065   -0.4331 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1651   -2.6856   -0.2610 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9187    3.4638    1.4135 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9457    4.8590    1.6072 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0076    4.2481    0.3669 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.0215    2.2375   -1.0903 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9819    0.8493   -1.3059 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9827    3.1589    0.4672 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4812    2.3333    0.4499 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5255   -0.2137    0.1111 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  2  3  2  0  0  0  0
  2 15  1  0  0  0  0
  3  4  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 15  1  0  0  0  0
 14 23  1  0  0  0  0
 14 24  1  0  0  0  0
 15 25  1  0  0  0  0
M  END
$$$$