Entry |
|
Name |
Lufenuron (USP/INN); Program [veterinary] (TN) |
Formula |
C17H8Cl2F8N2O3
|
Exact mass |
509.9784
|
Mol weight |
511.1502
|
Structure |
|
Simcomp |
|
Remark |
|
Efficacy |
Antiparasitic (veterinary), Insecticide (veterinary), Chitin synthesis inhibitor |
Comment |
Benzoyl phenylurea derivative
veterinary medicine
|
Other DBs |
|
KCF data |
ATOM 32
1 C8x C 15.0240 -18.9338
2 C8x C 15.0240 -20.3310
3 C8x C 16.2340 -21.0296
4 C8y C 17.4440 -20.3310
5 C8y C 17.4440 -18.9338
6 C8y C 16.2340 -18.2352
7 C5a C 18.6791 -18.2352
8 N1b N 19.8892 -18.9338
9 C5a C 21.0991 -18.2352
10 N1b N 22.3091 -18.9338
11 C8y C 23.5192 -18.2352
12 X F 16.2340 -16.8382
13 X F 18.6727 -21.0406
14 O5a O 18.6853 -16.8383
15 O5a O 21.0991 -16.8380
16 C8y C 24.7498 -18.9460
17 C8x C 25.9600 -18.2476
18 C8y C 25.9602 -16.8504
19 C8y C 24.7296 -16.1396
20 C8x C 23.5194 -16.8380
21 O2a O 27.2020 -16.1394
22 X Cl 24.7298 -14.7422
23 X Cl 24.7494 -20.3309
24 C1d C 28.5527 -16.9014
25 C1c C 29.7627 -17.6000
26 X F 29.2544 -15.6858
27 X F 27.8575 -18.1057
28 C1d C 30.9702 -16.9028
29 X F 32.1803 -16.2042
30 X F 31.6653 -18.1069
31 X F 30.2684 -15.6869
32 X F 29.7627 -19.0024
BOND 33
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 5 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 6 12 1
13 4 13 1
14 7 14 2
15 9 15 2
16 11 16 2
17 16 17 1
18 17 18 2
19 18 19 1
20 19 20 2
21 11 20 1
22 18 21 1
23 19 22 1
24 16 23 1
25 24 25 1
26 24 26 1
27 24 27 1
28 25 28 1
29 28 29 1
30 28 30 1
31 28 31 1
32 25 32 1
33 21 24 1
|