Molecule FYI-1003731

A

Molecule Summary:

ID: FYI-1003731
Names:
InChIKey: WRYFMDZSFJQZCD-UHFFFAOYSA-N
SMILES: COc5c(NC(=O)Nc3ccc2[nH]c(c1ccc(C)cc1)nc2c3)ccc4OC(C)(C)C=Cc45

Received at FYIcenter.com on: 2023-07-24

Molecule ID: FYI-1003731 Edit

Molecule Structure InChIKey: WRYFMDZSFJQZCD-UHFFFAOYSA-N

Molecule Structure SMILES String: COc5c(NC(=O)Nc3ccc2[nH]c(c1ccc(C)cc1)nc2c3)ccc4OC(C)(C)C=Cc45

Download SDF Download SVG Structure in 2D SDF:

FYI-1003731
FYIcenter.com

 34 38  0  0  0  0  0  0  0  0999 V2000
    8.6746    1.2124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   11.0995    2.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3119    3.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5243    2.6124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5243    1.2124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.8558    0.7798    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003731-3D
FYIcenter.com

 60 64  0  0  0  0  0  0  0  0999 V2000
    0.8953   -1.9837    1.5698 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2191   -1.6007    1.8866 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5221   -0.2594    1.9599 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2023-07-29, 2452👍, 0💬