Molecule Editor

Molecule ID: FYI-1016255 Edit

Molecule Structure InChIKey: XNCOSPRUTUOJCJ-UHFFFAOYSA-N

Molecule Structure SMILES String: N=C(N)NC(=N)N

Download SDF Download SVG Structure in 2D SDF:

FYI-1016255
FYIcenter.com

  7  6  0  0  0  0  0  0  0  0999 V2000
    4.8497    0.0000    0.0000 N   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 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 N   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
    1.2124    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   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  2  0  0  0  0
  7  5  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016255-3D
FYIcenter.com

 14 13  0     0  0  0  0  0  0999 V2000
   -0.0555    0.7739    0.1325 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3769    0.5556    0.1324 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1511   -1.3367   -0.2282 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8392   -0.3065    1.1155 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6828    0.1201   -1.1829 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1170    0.0182    0.0166 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1784    0.1754    0.0142 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5101    1.5449    0.3117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2082   -0.0184    0.0441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0319   -1.8343   -0.3018 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3040   -1.8824   -0.3415 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4305   -0.2441    2.0416 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7529   -0.7396    1.0375 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6006   -0.3356   -1.1328 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  2  0  0  0  0
  1  7  1  0  0  0  0
  2  6  1  0  0  0  0
  2  8  1  0  0  0  0
  2  9  1  0  0  0  0
  3  6  1  0  0  0  0
  3 10  1  0  0  0  0
  3 11  1  0  0  0  0
  4  7  1  0  0  0  0
  4 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5  7  2  0  0  0  0
  5 14  1  0  0  0  0
M  END
$$$$