Molecule FYI-1004965

A

Molecule Summary:

ID: FYI-1004965
Names:
InChIKey: WINHZLLDWRZWRT-SFQUDFHCSA-N
SMILES: CCN(CC)CCNC(=O)c3c(C)[nH]c(C=c1c(=O)[nH]c2ccc(F)cc12)c3C

Received at FYIcenter.com on: 2023-10-04

Molecule ID: FYI-1004965 Edit

Molecule Structure InChIKey: WINHZLLDWRZWRT-SFQUDFHCSA-N

Molecule Structure SMILES String: CCN(CC)CCNC(=O)c3c(C)[nH]c(C=c1c(=O)[nH]c2ccc(F)cc12)c3C

Download SDF Download SVG Structure in 2D SDF:

FYI-1004965
FYIcenter.com

 29 31  0  0  0  0  0  0  0  0999 V2000
   15.3128    6.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1005    5.6001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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   12.8879    7.7001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6755    8.4001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6755    5.6001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4631    6.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2507    5.6001    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0382    6.3001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0382    7.7001    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8258    5.6001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.5716    7.1394    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.2789    1.5701    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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    5.2557    7.5390    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 27 18  1  0  0  0  0
 28 27  2  0  0  0  0
 29 12  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1004965-3D
FYIcenter.com

 56 58  0     0  0  0  0  0  0999 V2000
    2.9921    3.6245    0.3119 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4331    1.2513    1.3280 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9921   -3.1757   -0.8245 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4597    0.2324   -0.5017 N   0  0  0  0  0  0  0  0  0  0  0  0
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 29 56  1  0  0  0  0
M  END
$$$$

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2023-10-13, 1697👍, 0💬