Molecule Editor

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
    6.9156    8.4465    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7031    9.1465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7031   10.5465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4907    8.4465    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3340    9.2351    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9962    8.8224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4847    7.5192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1847    6.3068    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3961    5.1500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    5.2547    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    1.2148    2.7320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.2219    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.4032    2.4181    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0070    2.5227    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.5691    6.0981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 10  9  1  0  0  0  0
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 19 18  1  0  0  0  0
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 21 16  1  0  0  0  0
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 22 13  1  0  0  0  0
 23 10  1  0  0  0  0
 24 23  1  0  0  0  0
 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
    1.0550    0.7674    1.3699 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4405    2.5300    0.2296 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8012   -1.2605    0.0368 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2890    1.8799   -0.7685 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9371    1.0676   -0.7353 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3863   -3.3008   -0.1336 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$