Molecule FYI-1001093

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A

Molecule Summary:

ID: FYI-1001093
SMILES: C1CC2=NC=CN12

Received at FYIcenter.com on: 2021-12-22

Molecule ID: FYI-1001093 Edit

Molecule Structure SMILES String: C1CC2=NC=CN12

Download SDF Download SVG Structure in 2D SDF:

FYI-1001093
FYIcenter.com

  7  8  0  0  0  0  0  0  0  0999 V2000
    0.0000    1.8326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.4326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4000    0.4326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7316    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5543    1.1326    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7316    2.2652    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4000    1.8326    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  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
  7  1  1  0  0  0  0
  7  3  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1001093-3D
FYIcenter.com

 13 14  0  0  0  0  0  0  0  0999 V2000
    1.4780    0.5560   -0.0592 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2729    1.8723    0.0038 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4094    0.9990    0.3592 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6120    0.7508   -0.0742 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6197   -0.6310   -0.1831 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3533   -1.1589    0.0211 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6321   -0.0994    0.4720 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1681    0.1889   -1.0436 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6201    0.5043    0.6204 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9603    2.5343    0.8185 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3988    2.4590   -0.9083 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5156   -1.1588   -0.4883 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9448   -2.1523   -0.0872 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  7  1  0  0  0  0
  1  8  1  0  0  0  0
  1  9  1  0  0  0  0
  2  3  1  0  0  0  0
  2 10  1  0  0  0  0
  2 11  1  0  0  0  0
  3  4  2  0  0  0  0
  3  7  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5 12  1  0  0  0  0
  6  7  1  0  0  0  0
  6 13  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2022-04-13, 2024👍, 0💬