Molecule FYI-1013680

A

Molecule Summary:

ID: FYI-1013680
Names:
InChIKey: IDQHQFKESZAIAT-SDNWHVSQSA-N
SMILES: Cc5ccc(CN(c2ccc(C(=O)/C=C/c1ccc(N(=O)=O)o1)cc2)c3ccnc4cc(Cl)ccc34)cc5

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

Molecule ID: FYI-1013680 Edit

Molecule Structure InChIKey: IDQHQFKESZAIAT-SDNWHVSQSA-N

Molecule Structure SMILES String: Cc5ccc(CN(c2ccc(C(=O)/C=C/c1ccc(N(=O)=O)o1)cc2)c3ccnc4cc(Cl)ccc34)cc5

Download SDF Download SVG Structure in 2D SDF:

FYI-1013680
FYIcenter.com

 38 42  0  0  0  0  0  0  0  0999 V2000
   16.8143    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   15.6019    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6019    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3894    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1770    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1770    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9646    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.7522    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.7522    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9646    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9646    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.1770    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.1770    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0000    3.1913    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.1148    8.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    9.5396    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3894    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
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 11 10  1  0  0  0  0
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 37 36  2  0  0  0  0
 37 20  1  0  0  0  0
 38  6  2  0  0  0  0
 38  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1013680-3D
FYIcenter.com

 60 64  0  0  0  0  0  0  0  0999 V2000
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   -3.2359    2.4877   -0.0436 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8809    2.2596   -0.5928 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4480    9.1254    1.6171 C   0  0  0  0  0  0  0  0  0  0  0  0
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  2  3  1  0  0  0  0
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 38 60  1  0  0  0  0
M  END
$$$$

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2025-02-16, 1132👍, 0💬