Molecule FYI-1010231

A

Molecule Summary:

ID: FYI-1010231
Names:
InChIKey: MLSWQIDSXBBESZ-UHFFFAOYSA-M
SMILES: O=C(Nc2nc(c1ccc[nH]1)cs2)c5ccc4nc(c3ccc(C(=O)O[Na])cc3)sc4c5

Received at FYIcenter.com on: 2024-06-03

Molecule ID: FYI-1010231 Edit

Molecule Structure InChIKey: MLSWQIDSXBBESZ-UHFFFAOYSA-M

Molecule Structure SMILES String: O=C(Nc2nc(c1ccc[nH]1)cs2)c5ccc4nc(c3ccc(C(=O)O[Na])cc3)sc4c5

Download SDF Download SVG Structure in 2D SDF:

FYI-1010231
FYIcenter.com

 32 36  0  0  0  0  0  0  0  0999 V2000
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    5.8239   12.9904    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5450   13.5598    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6081   12.5194    0.0000 C   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-1010231-3D
FYIcenter.com

 45 49  0  0  0  0  0  0  0  0999 V2000
    2.4088    0.6612    0.1423 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1943   -0.3363   -0.5331 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0088   -0.4656   -1.1996 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0674    0.4672   -1.2471 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.1156   -2.5398   -1.4807 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.8131   -4.3456    0.6390 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8389   -5.3154    1.0928 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.9692   -7.4658    0.8726 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2024-07-11, 848👍, 0💬