Molecule Editor

Molecule ID: FYI-1006325 Edit

Molecule Structure InChIKey: SEYPHQTWTBXMQU-UHFFFAOYSA-N

Molecule Structure SMILES String: Cc4ccc(CN(Cc2ccc(c1ccccc1S(=O)(=O)NC=N)cc2)C(=O)c3ccccc3Cl)cc4

Download SDF Download SVG Structure in 2D SDF:

FYI-1006325
FYIcenter.com

 37 40  0  0  0  0  0  0  0  0999 V2000
   13.3368    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120   10.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9120    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    9.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    8.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    6.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    7.0000    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
    0.0000    7.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    4.9000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2746    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8498    2.8000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    9.6995   11.2000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   10.3995   12.4124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9995   12.4124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871   10.5000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746   11.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622   10.5000    0.0000 N   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  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  6  1  1  0  0  0  0
  7  5  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
 11 10  1  0  0  0  0
 12 11  2  0  0  0  0
 12  7  1  0  0  0  0
 13 10  1  0  0  0  0
 14 13  1  0  0  0  0
 15 14  1  0  0  0  0
 16 15  1  0  0  0  0
 17 16  2  0  0  0  0
 18 17  1  0  0  0  0
 19 18  2  0  0  0  0
 20 19  1  0  0  0  0
 21 20  2  0  0  0  0
 21 16  1  0  0  0  0
 22 19  1  0  0  0  0
 23 14  1  0  0  0  0
 24 23  2  0  0  0  0
 25 23  1  0  0  0  0
 26 25  2  0  0  0  0
 27 26  1  0  0  0  0
 28 27  2  0  0  0  0
 29 28  1  0  0  0  0
 30 29  2  0  0  0  0
 30 25  1  0  0  0  0
 31 30  1  0  0  0  0
 32  4  1  0  0  0  0
 33 32  2  0  0  0  0
 34 32  2  0  0  0  0
 35 32  1  0  0  0  0
 36 35  1  0  0  0  0
 37 36  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1006325-3D
FYIcenter.com

 63 66  0  0  0  0  0  0  0  0999 V2000
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    2.9902    2.4454    1.1993 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.7785    3.7248    2.3468 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7391    3.1260    1.5513 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3609    2.1414    0.6446 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0028    1.7699    0.4947 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6692    0.4463   -0.6584 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.3374   -0.0867   -0.4927 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1558    0.8873   -1.9483 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7019   -0.7775   -0.1605 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2713   -1.7944    0.6899 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$