Molecule FYI-1005465

A

Molecule Summary:

ID: FYI-1005465
Names:
InChIKey: HIUHSJMPWQJQFZ-ZWBSKDEBSA-N
SMILES: COc5ccc([C@@H]2CN(c1ccc(=O)n(C)n1)C[C@H]2C(=O)N4CCN(c3cc(Cl)c(C)cc3C(C)N(C(C)=O)C(C)C)CC4)c(OC)c5

Received at FYIcenter.com on: 2023-10-30

Molecule ID: FYI-1005465 Edit

Molecule Structure InChIKey: HIUHSJMPWQJQFZ-ZWBSKDEBSA-N

Molecule Structure SMILES String: COc5ccc([C@@H]2CN(c1ccc(=O)n(C)n1)C[C@H]2C(=O)N4CCN(c3cc(Cl)c(C)cc3C(C)N(C(C)=O)C(C)C)CC4)c(OC)c5

Download SDF Download SVG Structure in 2D SDF:

FYI-1005465
FYIcenter.com

 48 52  0  0  0  0  0  0  0  0999 V2000
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    3.6373    2.5993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.5993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.1993    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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 13 48  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005465-3D
FYIcenter.com

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 37 38  1  0  0  0  0
 37 39  2  0  0  0  0
 38 78  1  0  0  0  0
 38 79  1  0  0  0  0
 38 80  1  0  0  0  0
 40 41  1  0  0  0  0
 40 42  1  0  0  0  0
 40 81  1  0  0  0  0
 41 82  1  0  0  0  0
 41 83  1  0  0  0  0
 41 84  1  0  0  0  0
 42 85  1  0  0  0  0
 42 86  1  0  0  0  0
 42 87  1  0  0  0  0
 43 44  1  0  0  0  0
 43 88  1  0  0  0  0
 43 89  1  0  0  0  0
 44 90  1  0  0  0  0
 44 91  1  0  0  0  0
 45 46  1  0  0  0  0
 45 48  1  0  0  0  0
 46 47  1  0  0  0  0
 47 92  1  0  0  0  0
 47 93  1  0  0  0  0
 47 94  1  0  0  0  0
 48 95  1  0  0  0  0
M  END
$$$$

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2023-11-06, 2497👍, 0💬