Molecule FYI-1003350

A

Molecule Summary:

ID: FYI-1003350
Names:
InChIKey: MLHDUJJGUSLGRV-CYBMUJFWSA-N
SMILES: Cc4ccc(F)c([C@@H](C)Nc2c(Cl)c(C)nc3cc(F)c(c1cnc(C(C)(C)O)nc1)nc23)c4

Received at FYIcenter.com on: 2023-06-03

Molecule ID: FYI-1003350 Edit

Molecule Structure InChIKey: MLHDUJJGUSLGRV-CYBMUJFWSA-N

Molecule Structure SMILES String: Cc4ccc(F)c([C@@H](C)Nc2c(Cl)c(C)nc3cc(F)c(c1cnc(C(C)(C)O)nc1)nc23)c4

Download SDF Download SVG Structure in 2D SDF:

FYI-1003350
FYIcenter.com

 34 37  0  0  1  0  0  0  0  0999 V2000
    6.0622    6.1124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    7.5124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    8.2124    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    7.5124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    8.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    9.6124    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    7.5124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.9995    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2746    9.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   10.3124    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    7.5124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  2  3  1  1  0  0  0
  4  3  1  0  0  0  0
  5  4  2  0  0  0  0
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 33 32  1  0  0  0  0
 34 29  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003350-3D
FYIcenter.com

 58 61  0  0  1  0  0  0  0  0999 V2000
   -0.7259   -2.2596    0.9955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5764   -1.3303   -0.1721 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.1665    1.2607   -3.3511 F   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2023-06-19, 1621👍, 0💬