Molecule FYI-1013682

A

Molecule Summary:

ID: FYI-1013682
Names:
InChIKey: YWYMEMPSMUNEHG-CXUHLZMHSA-N
SMILES: Cc5ccc(CN(c2ccc(C(=O)/C=C/c1cccc(N(=O)=O)c1)cc2)c3ccnc4cc(Cl)ccc34)cc5

Received at FYIcenter.com on: 2025-01-21

Molecule ID: FYI-1013682 Edit

Molecule Structure InChIKey: YWYMEMPSMUNEHG-CXUHLZMHSA-N

Molecule Structure SMILES String: Cc5ccc(CN(c2ccc(C(=O)/C=C/c1cccc(N(=O)=O)c1)cc2)c3ccnc4cc(Cl)ccc34)cc5

Download SDF Download SVG Structure in 2D SDF:

FYI-1013682
FYIcenter.com

 39 43  0  0  0  0  0  0  0  0999 V2000
   18.1866    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   16.9742    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9742    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8497    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    0.0000    0.0000 C   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  2  0  0  0  0
  6  5  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
 10  5  1  0  0  0  0
 11 10  1  0  0  0  0
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 13 12  1  0  0  0  0
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 22 21  1  0  0  0  0
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 32 30  2  0  0  0  0
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 34 33  1  0  0  0  0
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 35 27  1  0  0  0  0
 36 24  2  0  0  0  0
 37 23  1  0  0  0  0
 38 37  2  0  0  0  0
 38 20  1  0  0  0  0
 39  6  2  0  0  0  0
 39  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1013682-3D
FYIcenter.com

 63 67  0  0  0  0  0  0  0  0999 V2000
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    6.4622    5.7498    0.7945 C   0  0  0  0  0  0  0  0  0  0  0  0
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  1 41  1  0  0  0  0
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  2 39  2  0  0  0  0
  3  4  2  0  0  0  0
  3 43  1  0  0  0  0
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  5 38  2  0  0  0  0
  6  7  1  0  0  0  0
  6 45  1  0  0  0  0
  6 46  1  0  0  0  0
  7  8  1  0  0  0  0
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 39 63  1  0  0  0  0
M  END
$$$$

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2025-02-16, 623👍, 0💬