Molecule FYI-1016766

A

Molecule Summary:

ID: FYI-1016766
Names:
InChIKey: WAZOUGDYHDXOJK-UHFFFAOYSA-N
SMILES: Nc4cc(C(=O)NCc3ccc(N2CCCc1ccccc12)cc3)ncn4

Received at FYIcenter.com on: 2026-03-06

Molecule ID: FYI-1016766 Edit

Molecule Structure InChIKey: WAZOUGDYHDXOJK-UHFFFAOYSA-N

Molecule Structure SMILES String: Nc4cc(C(=O)NCc3ccc(N2CCCc1ccccc12)cc3)ncn4

Download SDF Download SVG Structure in 2D SDF:

FYI-1016766
FYIcenter.com

 27 30  0  0  0  0  0  0  0  0999 V2000
   13.3368    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.7617    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.5492    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3368    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    2.1000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.1244    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9119    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4871    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6995    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2746    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0622    4.2000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    6.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.9000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 N   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
    3.6373    2.8000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.9000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  8  3  1  0  0  0  0
  9  8  1  0  0  0  0
 10  9  1  0  0  0  0
 10  1  1  0  0  0  0
 11  9  1  0  0  0  0
 12 11  2  0  0  0  0
 13 12  1  0  0  0  0
 14 13  2  0  0  0  0
 15 14  1  0  0  0  0
 16 15  2  0  0  0  0
 16 11  1  0  0  0  0
 17 14  1  0  0  0  0
 18 17  1  0  0  0  0
 19 18  1  0  0  0  0
 20 19  2  0  0  0  0
 21 19  1  0  0  0  0
 22 21  2  0  0  0  0
 23 22  1  0  0  0  0
 24 23  2  0  0  0  0
 25 24  1  0  0  0  0
 26 25  2  0  0  0  0
 26 21  1  0  0  0  0
 27 23  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016766-3D
FYIcenter.com

 48 51  0     0  0  0  0  0  0999 V2000
   -3.1574   -0.4943    1.9380 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4100   -0.6267   -0.2893 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8578   -1.7976    0.0431 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7639   -0.3690   -1.1887 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4152    1.3834   -1.2890 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7750    2.7823    0.6037 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.7207   -1.4450   -0.1006 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3875   -1.5911   -0.8229 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2896   -0.0564   -0.3407 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2497    1.0127   -0.1202 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8680    0.7070   -0.1183 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1057   -1.1323   -0.0714 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6881    2.3393    0.0365 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9682    1.7804    0.0387 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4004   -1.7193   -1.1220 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5257   -1.0426    1.1940 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7743    3.3740    0.2054 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4143    3.0946    0.2039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4648   -2.1272    0.3584 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1152   -2.2167   -0.9071 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2404   -1.5400    1.4088 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8392   -2.6586    0.5883 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4401   -0.7721    0.7755 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4943    0.0085    0.0783 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1339    1.0488    0.7209 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0948    1.7072   -0.0189 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7213    0.3508   -1.8044 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4296   -2.2029   -0.4521 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5768   -1.6085    0.9755 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5108   -1.4342   -1.9023 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0421   -2.6240   -0.6843 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1439    0.1005    0.3282 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6520    0.0218   -1.3731 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7511    2.5689    0.0242 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8938    1.6111    0.0272 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8342   -1.7902   -2.1161 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0651   -0.5937    2.0243 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6942    3.8987    0.3252 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1223    4.3950    0.3284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4253   -2.6702   -1.7338 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1989   -1.4632    2.3998 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9466   -3.6393    0.1104 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0292   -2.8087    1.6578 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1508   -1.9507   -0.9178 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9016    1.3371    1.7392 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9582    0.0691   -2.8231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8757    2.7704    1.6112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4828    3.2567    0.0568 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 23  2  0  0  0  0
  2  8  1  0  0  0  0
  2 11  1  0  0  0  0
  2 12  1  0  0  0  0
  3 22  1  0  0  0  0
  3 23  1  0  0  0  0
  3 44  1  0  0  0  0
  4 24  1  0  0  0  0
  4 27  2  0  0  0  0
  5 26  2  0  0  0  0
  5 27  1  0  0  0  0
  6 26  1  0  0  0  0
  6 47  1  0  0  0  0
  6 48  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  7 28  1  0  0  0  0
  7 29  1  0  0  0  0
  8 30  1  0  0  0  0
  8 31  1  0  0  0  0
  9 10  1  0  0  0  0
  9 32  1  0  0  0  0
  9 33  1  0  0  0  0
 10 11  1  0  0  0  0
 10 13  2  0  0  0  0
 11 14  2  0  0  0  0
 12 15  2  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 13 34  1  0  0  0  0
 14 18  1  0  0  0  0
 14 35  1  0  0  0  0
 15 20  1  0  0  0  0
 15 36  1  0  0  0  0
 16 21  2  0  0  0  0
 16 37  1  0  0  0  0
 17 18  2  0  0  0  0
 17 39  1  0  0  0  0
 18 38  1  0  0  0  0
 19 20  2  0  0  0  0
 19 21  1  0  0  0  0
 19 22  1  0  0  0  0
 20 40  1  0  0  0  0
 21 41  1  0  0  0  0
 22 42  1  0  0  0  0
 22 43  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  2  0  0  0  0
 25 26  1  0  0  0  0
 25 45  1  0  0  0  0
 27 46  1  0  0  0  0
M  END
$$$$

✍: FYIcenter.com

2026-03-22, 641👍, 0💬