Molecule FYI-1014264

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A

Molecule Summary:

ID: FYI-1014264
Names:
InChIKey: HFACYLZERDEVSX-UHFFFAOYSA-N
SMILES: Nc2ccc(c1ccc(N)cc1)cc2

Received at FYIcenter.com on: 2025-03-18

Molecule ID: FYI-1014264 Edit

Molecule Structure InChIKey: HFACYLZERDEVSX-UHFFFAOYSA-N

Molecule Structure SMILES String: Nc2ccc(c1ccc(N)cc1)cc2

Download SDF Download SVG Structure in 2D SDF:

FYI-1014264
FYIcenter.com

 14 15  0  0  0  0  0  0  0  0999 V2000
    2.4249    2.8000    0.0000 C   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    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 C   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 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    4.9000    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  2  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
  6  1  1  0  0  0  0
  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  9  8  1  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
 12  7  1  0  0  0  0
 13 10  1  0  0  0  0
 14  3  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1014264-3D
FYIcenter.com

 26 27  0     0  0  0  0  0  0999 V2000
   -4.9235   -0.0002    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.9235   -0.0002    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7233    0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7233    0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4209    1.1669   -0.3126 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4210    1.1670    0.3126 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4208   -1.1667    0.3125 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4207   -1.1667   -0.3125 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5132    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5131   -0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8158    1.1668   -0.3125 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8159    1.1668    0.3125 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8156   -1.1669    0.3126 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8156   -1.1669   -0.3125 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9215    2.0905   -0.5921 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9215    2.0906    0.5921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9213   -2.0903    0.5921 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9213   -2.0903   -0.5921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3485    2.0805   -0.5642 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3486    2.0804    0.5643 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3482   -2.0806    0.5643 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3481   -2.0806   -0.5643 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4296   -0.8461    0.2257 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4298    0.8453   -0.2272 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4296   -0.8458   -0.2272 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4297    0.8456    0.2258 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  1 23  1  0  0  0  0
  1 24  1  0  0  0  0
  2 10  1  0  0  0  0
  2 25  1  0  0  0  0
  2 26  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  2  0  0  0  0
  3  7  1  0  0  0  0
  4  6  2  0  0  0  0
  4  8  1  0  0  0  0
  5 11  1  0  0  0  0
  5 15  1  0  0  0  0
  6 12  1  0  0  0  0
  6 16  1  0  0  0  0
  7 13  2  0  0  0  0
  7 17  1  0  0  0  0
  8 14  2  0  0  0  0
  8 18  1  0  0  0  0
  9 11  2  0  0  0  0
  9 13  1  0  0  0  0
 10 12  2  0  0  0  0
 10 14  1  0  0  0  0
 11 19  1  0  0  0  0
 12 20  1  0  0  0  0
 13 21  1  0  0  0  0
 14 22  1  0  0  0  0
M  END
$$$$

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2025-04-11, 1314👍, 0💬