Molecule FYI-1000455

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A

Molecule Summary:

ID: FYI-1000455
SMILES: CN(C)C(=N)N=C(N)N

Received at FYIcenter.com on: 2021-07-08

Molecule ID: FYI-1000455 Edit

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

Download SDF Download SVG Structure in 2D SDF:

FYI-1000455
FYIcenter.com

  9  8  0  0  0  0  0  0  0  0999 V2000
    6.0622    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    1.4000    0.0000 N   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
    3.6374    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6374    3.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  2  1  0  0  0  0
  5  4  2  0  0  0  0
  6  4  1  0  0  0  0
  7  6  2  0  0  0  0
  8  7  1  0  0  0  0
  9  7  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1000455-3D
FYIcenter.com

 20 19  0  0  0  0  0  0  0  0999 V2000
    1.0308   -0.0827   -0.0263 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4781   -0.1583    0.0474 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2247    0.7729   -0.7860 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1490   -1.0567    0.8544 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5190   -1.9026    1.6140 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5242   -1.0625    0.8591 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.2149   -1.8746    1.5910 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7573   -2.8126    2.4380 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.5618   -1.8547    1.5728 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6776    0.6876   -0.7187 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6120    0.1515    0.9586 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6165   -1.0382   -0.3674 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5659    1.4239   -1.3722 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8580    0.2331   -1.4980 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8529    1.4242   -0.1695 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5196   -1.7667    1.4933 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7372   -2.8668    2.4832 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3167   -3.4331    2.9918 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0209   -1.1869    0.9719 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1187   -2.4772    2.1334 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3 13  1  0  0  0  0
  3 14  1  0  0  0  0
  3 15  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  5 16  1  0  0  0  0
  6  7  2  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  8 17  1  0  0  0  0
  8 18  1  0  0  0  0
  9 19  1  0  0  0  0
  9 20  1  0  0  0  0
M  END
$$$$

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2021-10-02, 844👍, 0💬