Molecule FYI-1004753

A

Molecule Summary:

ID: FYI-1004753
Names:
InChIKey: OVJATCRWQZLNLT-UHFFFAOYSA-N
SMILES: Cc4cc(/C(N)=N/OC(=O)Nc3ccc(C(F)(F)F)c(Cn2cnc1ncnc(N)c12)c3)no4

Received at FYIcenter.com on: 2023-09-23

Molecule ID: FYI-1004753 Edit

Molecule Structure InChIKey: OVJATCRWQZLNLT-UHFFFAOYSA-N

Molecule Structure SMILES String: Cc4cc(/C(N)=N/OC(=O)Nc3ccc(C(F)(F)F)c(Cn2cnc1ncnc(N)c12)c3)no4

Download SDF Download SVG Structure in 2D SDF:

FYI-1004753
FYIcenter.com

 34 37  0  0  0  0  0  0  0  0999 V2000
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   12.1245    8.2553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    8.9553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6995    8.2553    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 32  9  2  0  0  0  0
 33  4  2  0  0  0  0
 34 33  1  0  0  0  0
 34  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004753-3D
FYIcenter.com

 50 53  0  0  0  0  0  0  0  0999 V2000
   -4.0589    1.3333    4.4251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4514    0.0085    4.2078 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7155   -1.0230    3.3475 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7677   -2.0210    3.6821 C   0  0  0  0  0  0  0  0  0  0  0  0
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 32 50  1  0  0  0  0
 33 34  1  0  0  0  0
M  END
$$$$

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2023-10-05, 1971👍, 0💬