Molecule FYI-1013672

A

Molecule Summary:

ID: FYI-1013672
Names:
InChIKey: TUEDBCKXFUUFFQ-UHFFFAOYSA-N
SMILES: CCS(=O)(=O)c4cc(c1ncccc1OC)n3ncc(C2CCCCC2)c3n4

Received at FYIcenter.com on: 2025-01-20

Molecule ID: FYI-1013672 Edit

Molecule Structure InChIKey: TUEDBCKXFUUFFQ-UHFFFAOYSA-N

Molecule Structure SMILES String: CCS(=O)(=O)c4cc(c1ncccc1OC)n3ncc(C2CCCCC2)c3n4

Download SDF Download SVG Structure in 2D SDF:

FYI-1013672
FYIcenter.com

 28 31  0  0  0  0  0  0  0  0999 V2000
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 27 17  1  0  0  0  0
 28 27  1  0  0  0  0
 28  6  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1013672-3D
FYIcenter.com

 52 55  0  0  0  0  0  0  0  0999 V2000
    1.1299   -1.8131   -0.0055 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1302   -0.9134    1.5998 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.7382    0.4661    1.3630 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7256   -1.6103    2.8062 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.8175    2.1528    2.9919 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4951    3.3121    3.1086 C   0  0  0  0  0  0  0  0  0  0  0  0
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 27 28  1  0  0  0  0
M  END
$$$$

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2025-02-16, 1288👍, 0💬