Molecule FYI-1005839

A

Molecule Summary:

ID: FYI-1005839
Names:
InChIKey: ZICRLQLDVPONFA-UHFFFAOYSA-N
SMILES: CCNC(=O)C3CCCN(C(=O)c2cnc1ccccc1n2)CC3

Received at FYIcenter.com on: 2023-11-17

Molecule ID: FYI-1005839 Edit

Molecule Structure InChIKey: ZICRLQLDVPONFA-UHFFFAOYSA-N

Molecule Structure SMILES String: CCNC(=O)C3CCCN(C(=O)c2cnc1ccccc1n2)CC3

Download SDF Download SVG Structure in 2D SDF:

FYI-1005839
FYIcenter.com

 24 26  0  0  0  0  0  0  0  0999 V2000
    9.3405    8.4465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1280    9.1465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 24  6  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005839-3D
FYIcenter.com

 46 48  0     1  0  0  0  0  0999 V2000
    2.9516   -1.0861   -1.1697 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4040    2.6531   -1.7190 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2245    1.7198    0.2674 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0761   -2.2826    0.6251 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7358    1.2213    0.3362 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3732   -0.5439   -1.7125 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3944   -0.3280    1.0514 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.2750    0.7443    0.4022 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3359    0.2269    2.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5792    1.7927   -0.4660 C   0  0  0  0  0  0  0  0  0  0  0  0
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 24 46  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2023-11-23, 1275👍, 0💬