Molecule FYI-1007864

A

Molecule Summary:

ID: FYI-1007864
Names:
InChIKey: SRAWPYWFAKRBPG-UHFFFAOYSA-N
SMILES: O=[N+](O)c4ccc(CN1CCOCC1)c(Nc3ccnc(Nc2ccc(Cl)cc2)n3)c4

Received at FYIcenter.com on: 2024-03-19

Molecule ID: FYI-1007864 Edit

Molecule Structure InChIKey: SRAWPYWFAKRBPG-UHFFFAOYSA-N

Molecule Structure SMILES String: O=[N+](O)c4ccc(CN1CCOCC1)c(Nc3ccnc(Nc2ccc(Cl)cc2)n3)c4

Download SDF Download SVG Structure in 2D SDF:

FYI-1007864
FYIcenter.com

 31 34  0  0  0  0  0  0  0  0999 V2000
    0.0000    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.6373    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2746    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6994    2.8000    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    8.4870    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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 28 27  1  0  0  0  0
 28 23  1  0  0  0  0
 29 18  1  0  0  0  0
 30 29  2  0  0  0  0
 31 29  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1007864-3D
FYIcenter.com

 53 56  0  0  0  0  0  0  0  0999 V2000
    1.4593    0.5140    0.2191 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4917   -0.0137    0.5732 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.0460    0.3982    1.7631 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1358   -1.0095   -0.2553 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6030   -1.3051   -1.5108 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2217   -2.2590   -2.3191 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4007   -2.9121   -1.9081 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0166   -3.9313   -2.8582 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.7559   -6.0512   -1.6338 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.6921   -4.0785    3.4147 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.4203   -4.3097    3.0506 C   0  0  0  0  0  0  0  0  0  0  0  0
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 28 51  1  0  0  0  0
 29 52  1  0  0  0  0
 31 53  1  0  0  0  0
M  END
$$$$

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2024-03-23, 143👍, 0💬