Molecule Editor

Molecule ID: FYI-1015836 Edit

Molecule Structure InChIKey: TYJMSARGRKPOBM-BHHNILQKSA-N

Molecule Structure SMILES String: Cc1ccccc1c4ccc3nc(N)c(C[C@@H](C)C(=O)N[C@@H]2CCOC(C)C2)cc3c4

Download SDF Download SVG Structure in 2D SDF:

FYI-1015836
FYIcenter.com

 31 34  0  0  1  0  0  0  0  0999 V2000
   16.9741    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    4.2000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2747    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0621    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    2.8000    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
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    4.8497    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.6995    0.0000    0.0000 N   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
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.9741    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.1865    2.1000    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  1  0  0  0  0
  4  5  1  6  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  8  6  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 11 10  2  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  2  0  0  0  0
 15 14  1  0  0  0  0
 16 15  2  0  0  0  0
 17 16  1  0  0  0  0
 17 12  2  0  0  0  0
 18 17  1  0  0  0  0
 19 18  2  0  0  0  0
 19 10  1  0  0  0  0
 20 19  1  0  0  0  0
 21 14  1  0  0  0  0
 22 21  2  0  0  0  0
 23 22  1  0  0  0  0
 24 23  2  0  0  0  0
 25 24  1  0  0  0  0
 26 25  2  0  0  0  0
 26 21  1  0  0  0  0
 27 26  1  0  0  0  0
  8 28  1  6  0  0  0
 29  4  1  0  0  0  0
 30 29  1  0  0  0  0
 30  1  1  0  0  0  0
 31 30  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015836-3D
FYIcenter.com

 62 65  0  0  1  0  0  0  0  0999 V2000
   -1.8410   -2.0817   -1.2945 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.9394    1.3787   -0.0586 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.2395   -1.2133   -0.0237 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.5146   -4.0525    1.1520 C   0  0  0  0  0  0  0  0  0  0  0  0
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    2.3006   -6.7779   -1.9731 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1468   -7.8104   -3.0694 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3416   -7.2610   -4.4914 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.7736   -6.7874   -4.7427 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9860   -8.3244   -5.5347 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$