Molecule FYI-1015757

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Molecule Summary:

ID: FYI-1015757
Names:
InChIKey: VHVUTJZQFZBIRR-UHFFFAOYSA-N
SMILES: Oc1ccnnc1

Received at FYIcenter.com on: 2025-10-07

Molecule ID: FYI-1015757 Edit

Molecule Structure InChIKey: VHVUTJZQFZBIRR-UHFFFAOYSA-N

Molecule Structure SMILES String: Oc1ccnnc1

Download SDF Download SVG Structure in 2D SDF:

FYI-1015757
FYIcenter.com

  7  7  0  0  0  0  0  0  0  0999 V2000
    0.0000    0.7000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.8000    0.0000 O   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
    2.4249    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   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  2  2  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  7  1  0  0  0  0
  4  6  2  0  0  0  0
  5  7  2  0  0  0  0
  6  7  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1015757-3D
FYIcenter.com

 11 11  0     0  0  0  0  0  0999 V2000
    2.2417    0.1428    0.0001 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6801   -0.0490    0.0002 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1305    1.1901    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3534   -1.3003   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0298    0.0060    0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9777   -1.2223    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1634    1.2327   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9121   -2.2244   -0.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6048   -2.1053   -0.0003 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7001    2.1943   -0.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6923   -0.1182    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  2  0  0  0  0
  2  3  1  0  0  0  0
  2  6  1  0  0  0  0
  2 11  1  0  0  0  0
  3  7  2  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4  8  1  0  0  0  0
  5  7  1  0  0  0  0
  6  9  1  0  0  0  0
  7 10  1  0  0  0  0
M  END
$$$$

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2025-10-14, 732👍, 0💬