Molecule FYI-1004669

A

Molecule Summary:

ID: FYI-1004669
Names:
InChIKey: ZTHBPMXEJQLNKX-CRKCGEKBSA-N
SMILES: Cc3cc(/C(N)=N/OC(=O)N/C(=C/CN)CC2=CN(c1cncc(C)c1N)COC2)no3

Received at FYIcenter.com on: 2023-09-20

Molecule ID: FYI-1004669 Edit

Molecule Structure InChIKey: ZTHBPMXEJQLNKX-CRKCGEKBSA-N

Molecule Structure SMILES String: Cc3cc(/C(N)=N/OC(=O)N/C(=C/CN)CC2=CN(c1cncc(C)c1N)COC2)no3

Download SDF Download SVG Structure in 2D SDF:

FYI-1004669
FYIcenter.com

 32 34  0  0  0  0  0  0  0  0999 V2000
   17.8468    5.0624    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2774    3.7834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9081    3.4923    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7616    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    0.0000    0.0000 N   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    1.4000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2747    1.4000    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    1.4000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    3.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.0407    1.5306    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.9774    2.5710    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
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 30  9  2  0  0  0  0
 31  4  2  0  0  0  0
 32 31  1  0  0  0  0
 32  2  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004669-3D
FYIcenter.com

 58 60  0  0  0  0  0  0  0  0999 V2000
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M  END
$$$$

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2023-09-23, 1596👍, 0💬