Molecule FYI-1005603

A

Molecule Summary:

ID: FYI-1005603
Names:
InChIKey: WPJYZCYPCSYODL-UHFFFAOYSA-N
SMILES: CC(C)(C)c4cc(c1ccc(Cl)c(F)c1)nc5cc(C(=O)N3CCN(c2ccc(C(=O)O)cn2)CC3(C)C)oc45

Received at FYIcenter.com on: 2023-11-07

Molecule ID: FYI-1005603 Edit

Molecule Structure InChIKey: WPJYZCYPCSYODL-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(C)(C)c4cc(c1ccc(Cl)c(F)c1)nc5cc(C(=O)N3CCN(c2ccc(C(=O)O)cn2)CC3(C)C)oc45

Download SDF Download SVG Structure in 2D SDF:

FYI-1005603
FYIcenter.com

 40 44  0  0  0  0  0  0  0  0999 V2000
   14.0153    9.1870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2277    8.4870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9277    9.6995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.4401    7.7870    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5277    7.2746    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2277    6.0621    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5277    4.8497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2277    3.6373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5277    2.4248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2277    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6277    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3277    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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   18.7277    2.4248    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   16.6277    3.6373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   11.0583    6.3532    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  2  1  0  0  0  0
  5  2  1  0  0  0  0
  6  5  2  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
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 37 23  1  0  0  0  0
 38 37  1  0  0  0  0
 39 37  1  0  0  0  0
 40 20  2  0  0  0  0
 40 17  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005603-3D
FYIcenter.com

 70 74  0     0  0  0  0  0  0999 V2000
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M  END
$$$$

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2023-11-13, 3168👍, 0💬