Molecule FYI-1015424

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A

Molecule Summary:

ID: FYI-1015424
Names:
InChIKey: MUTFZNSNLNQWLT-UHFFFAOYSA-N
SMILES: CC(=O)c3nnn(c2ccc1c(cnn1C)c2)c3C

Received at FYIcenter.com on: 2025-09-02

Molecule ID: FYI-1015424 Edit

Molecule Structure InChIKey: MUTFZNSNLNQWLT-UHFFFAOYSA-N

Molecule Structure SMILES String: CC(=O)c3nnn(c2ccc1c(cnn1C)c2)c3C

Download SDF Download SVG Structure in 2D SDF:

FYI-1015424
FYIcenter.com

 19 21  0  0  0  0  0  0  0  0999 V2000
    7.8034    7.9844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5908    8.6844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5908   10.0844    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3784    7.9844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0995    8.5538    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1626    7.5134    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8626    6.3010    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2932    5.0220    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1162    3.8894    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5466    2.6105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1543    2.4640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3314    3.5966    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    3.1640    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.7640    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3314    1.3314    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7640    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9009    4.8757    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2321    6.5921    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2725    5.6552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  2  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  1  0  0  0  0
  9  8  2  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
 15 11  1  0  0  0  0
 16 15  1  0  0  0  0
 17 12  2  0  0  0  0
 17  8  1  0  0  0  0
 18  7  1  0  0  0  0
 18  4  2  0  0  0  0
 19 18  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015424-3D
FYIcenter.com

 32 34  0  0  0  0  0  0  0  0999 V2000
    1.6521    0.5476    0.2560 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8005    0.1457   -0.6352 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0272   -1.0497   -0.8417 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5851    1.2007   -1.2681 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4184    2.5251   -0.9826 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3363    3.2094   -1.6464 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0265    2.3577   -2.4514 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9848    2.8725   -3.3699 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5977    4.1105   -3.1055 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.5846    4.6372   -3.9533 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9243    3.8932   -5.0937 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2989    2.6890   -5.4018 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8861    2.2797   -6.6177 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8180    3.1303   -7.0514 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.8279    4.0969   -6.1104 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.7352    5.2083   -6.2633 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3065    2.1749   -4.5446 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6268    1.0550   -2.1765 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2550   -0.2069   -2.6453 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4151   -0.2772    0.9350 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7766    0.7678   -0.3603 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9116    1.4180    0.8640 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3407    4.6752   -2.2077 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0653    5.5825   -3.7243 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6762    1.3923   -7.2000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4945    4.9564   -7.0085 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2202    5.4064   -5.3043 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1601    6.0761   -6.5951 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7856    1.2734   -4.8439 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1188   -0.0747   -3.2938 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5213   -0.8240   -3.1735 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6169   -0.7767   -1.7818 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 20  1  0  0  0  0
  1 21  1  0  0  0  0
  1 22  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4 18  2  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 18  1  0  0  0  0
  8  9  1  0  0  0  0
  8 17  2  0  0  0  0
  9 10  2  0  0  0  0
  9 23  1  0  0  0  0
 10 11  1  0  0  0  0
 10 24  1  0  0  0  0
 11 12  2  0  0  0  0
 11 15  1  0  0  0  0
 12 13  1  0  0  0  0
 12 17  1  0  0  0  0
 13 14  2  0  0  0  0
 13 25  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 26  1  0  0  0  0
 16 27  1  0  0  0  0
 16 28  1  0  0  0  0
 17 29  1  0  0  0  0
 18 19  1  0  0  0  0
 19 30  1  0  0  0  0
 19 31  1  0  0  0  0
 19 32  1  0  0  0  0
M  END
$$$$

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2025-11-06, 248👍, 0💬