Molecule FYI-1003738

A

Molecule Summary:

ID: FYI-1003738
Names:
InChIKey: JJDCMNRZOLNONI-UHFFFAOYSA-N
SMILES: CSc5nc(NCC2CCN(c1ncccn1)CC2)cc(Nc4ccc3c(ccn3C(C)C)c4)n5

Received at FYIcenter.com on: 2023-07-24

Molecule ID: FYI-1003738 Edit

Molecule Structure InChIKey: JJDCMNRZOLNONI-UHFFFAOYSA-N

Molecule Structure SMILES String: CSc5nc(NCC2CCN(c1ncccn1)CC2)cc(Nc4ccc3c(ccn3C(C)C)c4)n5

Download SDF Download SVG Structure in 2D SDF:

FYI-1003738
FYIcenter.com

 35 39  0  0  0  0  0  0  0  0999 V2000
   12.1244    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6995    6.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   15.7617    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    6.3000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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 19  8  1  0  0  0  0
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 35 21  2  0  0  0  0
 35  3  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003738-3D
FYIcenter.com

 67 71  0  0  0  0  0  0  0  0999 V2000
    1.3972   -0.2816    0.7414 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9680    0.0030   -0.1133 S   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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2023-08-03, 494👍, 0💬