Molecule FYI-1016115

A

Molecule Summary:

ID: FYI-1016115
Names:
InChIKey: ZPDBOSPJAJFCHH-UHFFFAOYSA-N
SMILES: COc5cncc(c4nc(NCC(c1ccc(C)o1)N2CCOCC2)c3cc(OC)c(OC)cc3n4)c5

Received at FYIcenter.com on: 2025-11-21

Molecule ID: FYI-1016115 Edit

Molecule Structure InChIKey: ZPDBOSPJAJFCHH-UHFFFAOYSA-N

Molecule Structure SMILES String: COc5cncc(c4nc(NCC(c1ccc(C)o1)N2CCOCC2)c3cc(OC)c(OC)cc3n4)c5

Download SDF Download SVG Structure in 2D SDF:

FYI-1016115
FYIcenter.com

 37 41  0  0  0  0  0  0  0  0999 V2000
   14.5494    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5494    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    9.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6996    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    7.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0623    7.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8499    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.8499    2.1000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6996    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  6  1  0  0  0  0
  8  7  1  0  0  0  0
  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
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 13 12  1  0  0  0  0
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 18 17  1  0  0  0  0
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 36 35  2  0  0  0  0
 36  8  1  0  0  0  0
 37  7  2  0  0  0  0
 37  3  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016115-3D
FYIcenter.com

 68 72  0  0  1  0  0  0  0  0999 V2000
    4.0883    0.2940   -5.2455 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6478   -0.1541   -3.9658 O   0  0  0  0  0  0  0  0  0  0  0  0
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    3.7979    0.3936   -1.6906 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.9198    4.4851   -2.3185 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5919    4.8787   -3.5538 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3087    6.1717   -3.7383 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9922    6.6305   -5.0210 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7856    5.6501   -6.0929 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3112    3.8707   -7.0925 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4126    4.3080   -8.4918 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$

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