Molecule FYI-1008383

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Molecule Summary:

ID: FYI-1008383
Names:
InChIKey: ALVMGJVBZPATCW-UHFFFAOYSA-N
SMILES: Cc1nc(F)cc(F)n1

Received at FYIcenter.com on: 2024-04-28

Molecule ID: FYI-1008383 Edit

Molecule Structure InChIKey: ALVMGJVBZPATCW-UHFFFAOYSA-N

Molecule Structure SMILES String: Cc1nc(F)cc(F)n1

Download SDF Download SVG Structure in 2D SDF:

FYI-1008383
FYIcenter.com

  9  9  0  0  0  0  0  0  0  0999 V2000
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2000    0.0000 F   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
    2.4249    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 F   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  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  4  2  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  7  2  0  0  0  0
  9  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1008383-3D
FYIcenter.com

 13 13  0     0  0  0  0  0  0999 V2000
    1.3878   -2.3033    0.0007 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.2628    2.3740    0.0006 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6445   -1.2225   -0.0001 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7089    1.1864   -0.0001 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2778   -0.0341    0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7687   -0.0738    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4062    0.0375   -0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7028   -1.1496   -0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6403    1.1854   -0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1378   -0.0836    1.0298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1809    0.8011   -0.5122 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1338   -0.9696   -0.5121 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4874    0.0664   -0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  2  9  1  0  0  0  0
  3  5  1  0  0  0  0
  3  8  2  0  0  0  0
  4  5  2  0  0  0  0
  4  9  1  0  0  0  0
  5  6  1  0  0  0  0
  6 10  1  0  0  0  0
  6 11  1  0  0  0  0
  6 12  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
  7 13  1  0  0  0  0
M  END
$$$$

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2024-07-11, 1332👍, 0💬