Molecule FYI-1003889

A

Molecule Summary:

ID: FYI-1003889
Names:
InChIKey: ZDOPMGQJYYHGJK-UHFFFAOYSA-N
SMILES: O=C(CN(Cc1ccccn1)Cc2ccccn2)n5c3ccccc3sc4ccccc45

Received at FYIcenter.com on: 2023-08-04

Molecule ID: FYI-1003889 Edit

Molecule Structure InChIKey: ZDOPMGQJYYHGJK-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C(CN(Cc1ccccn1)Cc2ccccn2)n5c3ccccc3sc4ccccc45

Download SDF Download SVG Structure in 2D SDF:

FYI-1003889
FYIcenter.com

 32 36  0  0  0  0  0  0  0  0999 V2000
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    1.2125    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   10.5136    6.9266    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2383    7.5041    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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 20 32  1  0  0  0  0
 20 28  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003889-3D
FYIcenter.com

 54 58  0  0  0  0  0  0  0  0999 V2000
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    3.0340   -0.7617    1.1564 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0053   -1.2713    2.1214 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7489   -1.9165    4.2820 C   0  0  0  0  0  0  0  0  0  0  0  0
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 20 25  2  0  0  0  0
 21 22  2  0  0  0  0
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 22 23  1  0  0  0  0
 22 48  1  0  0  0  0
 23 24  2  0  0  0  0
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 25 26  1  0  0  0  0
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 30 31  2  0  0  0  0
 30 53  1  0  0  0  0
 31 32  1  0  0  0  0
 31 54  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-08-09, 1955👍, 0💬