Molecule FYI-1016570

Home > Molecule

A

Molecule Summary:

ID: FYI-1016570
Names:
InChIKey: AHWADHCJVQITKX-XYOKQWHBSA-N
SMILES: CO/C(=N/S(=O)(=O)S(F)(F)F)c1ccccc1

Received at FYIcenter.com on: 2026-01-22

Molecule ID: FYI-1016570 Edit

Molecule Structure InChIKey: AHWADHCJVQITKX-XYOKQWHBSA-N

Molecule Structure SMILES String: CO/C(=N/S(=O)(=O)S(F)(F)F)c1ccccc1

Download SDF Download SVG Structure in 2D SDF:

FYI-1016570
FYIcenter.com

 17 17  0  0  0  0  0  0  0  0999 V2000
    7.2746    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    1.2124    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    1.9124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    1.2124    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4248    1.9124    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.1248    3.1248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7248    3.1248    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    1.2124    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.9124    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.5124    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.5124    2.4248    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    3.3124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.0124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    5.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    6.1124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    5.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.0124    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  5  2  0  0  0  0
  8  5  1  0  0  0  0
  9  8  1  0  0  0  0
 10  8  1  0  0  0  0
 11  8  1  0  0  0  0
 12  3  1  0  0  0  0
 13 12  2  0  0  0  0
 14 13  1  0  0  0  0
 15 14  2  0  0  0  0
 16 15  1  0  0  0  0
 17 16  2  0  0  0  0
 17 12  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016570-3D
FYIcenter.com

 25 25  0  0  0  0  0  0  0  0999 V2000
    1.2341   -0.3257    0.1342 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6661   -0.4140    0.1478 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2553   -1.0265    1.2160 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5407   -1.5930    2.1328 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1969   -2.3053    3.4331 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.5613   -3.6634    3.0750 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1690   -1.4146    4.0418 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7201   -2.5136    4.8542 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.3077   -3.2008    6.1555 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.1324   -1.1041    5.2670 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.5340   -3.4117    4.3161 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.7329   -0.8587    1.0573 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2447    0.3514    0.5600 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6224    0.5934    0.5521 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5010   -0.3598    1.0602 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0107   -1.5858    1.4960 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6397   -1.8501    1.4455 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9437    0.3068   -0.7102 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8623    0.1395    1.0530 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7985   -1.3185   -0.0069 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5782    1.1274    0.1905 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0081    1.5362    0.1728 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5663   -0.1522    1.1146 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6884   -2.3382    1.8939 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3139   -2.8380    1.7469 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 18  1  0  0  0  0
  1 19  1  0  0  0  0
  1 20  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3 12  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  2  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
 12 13  1  0  0  0  0
 12 17  2  0  0  0  0
 13 14  2  0  0  0  0
 13 21  1  0  0  0  0
 14 15  1  0  0  0  0
 14 22  1  0  0  0  0
 15 16  2  0  0  0  0
 15 23  1  0  0  0  0
 16 17  1  0  0  0  0
 16 24  1  0  0  0  0
 17 25  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2026-04-13, 432👍, 0💬