Molecule Editor

Molecule ID: FYI-1006298 Edit

Molecule Structure InChIKey: XVIIKLFZGSJDCQ-UHFFFAOYSA-N

Molecule Structure SMILES String: O=C5CCC(N4Cc3cc(CNC(=O)Nc1ccccc1c2ccccc2)ccc3C4=O)C(=O)N5

Download SDF Download SVG Structure in 2D SDF:

FYI-1006298
FYIcenter.com

 35 39  0  0  0  0  0  0  0  0999 V2000
    4.8499    0.7000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8499    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4870    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6996    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6996    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9523    5.1367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3218    4.8457    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.3829    6.4157    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.9906    6.2693    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0829    7.6281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4829    7.6281    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1829    8.8405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4829   10.0531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1829   11.2655    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.0829   10.0531    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.3829    8.8405    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9829    8.8405    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2125    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  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  2  0  0  0  0
  9  8  1  0  0  0  0
 10  9  2  0  0  0  0
 10  5  1  0  0  0  0
 11  8  1  0  0  0  0
 12 11  2  0  0  0  0
 13 11  1  0  0  0  0
 14 13  1  0  0  0  0
 14  7  1  0  0  0  0
 15 13  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  2  0  0  0  0
 20 18  1  0  0  0  0
 21 20  1  0  0  0  0
 21 15  1  0  0  0  0
 22 21  2  0  0  0  0
 23  2  1  0  0  0  0
 24 23  1  0  0  0  0
 25 24  2  0  0  0  0
 26 25  1  0  0  0  0
 27 26  2  0  0  0  0
 28 27  1  0  0  0  0
 29 28  2  0  0  0  0
 29 24  1  0  0  0  0
 30 25  1  0  0  0  0
 31 30  2  0  0  0  0
 32 31  1  0  0  0  0
 33 32  2  0  0  0  0
 34 33  1  0  0  0  0
 35 34  2  0  0  0  0
 35 30  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006298-3D
FYIcenter.com

 59 63  0     1  0  0  0  0  0999 V2000
   -4.2660   -2.5274   -1.6160 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4743    1.5631   -1.7312 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7697    2.6553   -0.4843 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7646    0.8900    2.1540 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4466   -0.6705   -0.1658 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6142    2.0837   -1.0662 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0436   -1.3520    1.6583 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5549    0.1641    0.8207 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7261   -0.1529   -0.5759 C   0  0  1  0  0  0  0  0  0  0  0  0
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   -6.7011   -0.1137    0.5908 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4455   -0.9638    0.9107 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5798   -1.9796   -0.0370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8600   -1.7977   -0.7303 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0256    0.4608    0.1184 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5120    1.2345   -1.1561 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -7.8510    1.8365   -0.4791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6205   -2.9551   -0.2267 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3325   -1.8757    1.5378 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4820   -2.8942    0.5783 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8976   -1.8374    2.3831 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4017    0.0012    1.5941 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2331    1.3670    0.5156 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$