Molecule FYI-1001752

A

Molecule Summary:

ID: FYI-1001752
SMILES: C[C@H]1CN(C[C@@H](C)O1)C(=O)C2C=NC(=CC=2)N3C(=NC=N3)[C@H](C)NC(=O)C4=CC(C(F)(F)F)=CC(C(F)(F)F)=C4

Received at FYIcenter.com on: 2022-11-21

Molecule ID: FYI-1001752 Edit

Molecule Structure SMILES String: C[C@H]1CN(C[C@@H](C)O1)C(=O)C2C=NC(=CC=2)N3C(=NC=N3)[C@H](C)NC(=O)C4=CC(C(F)(F)F)=CC(C(F)(F)F)=C4

Download SDF Download SVG Structure in 2D SDF:

FYI-1001752
FYIcenter.com

 40 43  0  0  1  0  0  0  0  0999 V2000
   15.3878   14.5511    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.0967   13.1817    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7653   12.7491    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4743   11.3796    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5146   10.4428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8461   10.8754    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8865    9.9387    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1372   12.2449    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.1427   10.9470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1022   11.8839    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8517    9.5776    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5201    9.1450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2291    7.7756    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.2695    6.8388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  5  1  0  0  0  0
  6  7  1  6  0  0  0
  8  6  1  0  0  0  0
  8  2  1  0  0  0  0
  9  4  1  0  0  0  0
 10  9  2  0  0  0  0
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 38 36  1  0  0  0  0
 39 36  1  0  0  0  0
 40 35  2  0  0  0  0
 40 27  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1001752-3D
FYIcenter.com

 64 67  0  0  1  0  0  0  0  0999 V2000
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 40 64  1  0  0  0  0
M  END
$$$$

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2022-12-14, 422👍, 0💬