Entry
Name
Nizofenone (INN)
Formula
C21H21ClN4O3
Exact mass
412.1302
Mol weight
412.87
Structure
Mol file KCF file DB search
Simcomp
Neighbor
Remark
Efficacy
Nootropic, Vasodilator (cerebral)
Comment
thromboxane A2 (TXA2) biosynthesis inhibitor
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303 ]
N NERVOUS SYSTEM
N06 PSYCHOANALEPTICS
N06B PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
N06BX Other psychostimulants and nootropics
N06BX10 Nizofenone
D08280 Nizofenone (INN)
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KCF data
Show ATOM 29
1 C1b C 28.7201 -16.5565
2 N1c N 29.9076 -15.8579
3 C8y C 27.4628 -15.8579
4 N4y N 26.4151 -16.6962
5 C8y C 26.4149 -18.0933
6 N5x N 27.0436 -14.5307
7 C8x C 25.6465 -14.5307
8 C8x C 25.2274 -15.8579
9 C1b C 29.9076 -14.4608
10 C1b C 31.0952 -16.5565
11 C1a C 31.0952 -13.7623
12 C1a C 32.3525 -15.8579
13 C8x C 20.3376 -18.7918
14 C8x C 20.3376 -20.1889
15 C8x C 21.5950 -20.8874
16 C8y C 21.5950 -18.0933
17 C8y C 22.7825 -18.7918
18 C8x C 22.7825 -20.1889
19 C5a C 23.9700 -18.0933
20 C8y C 25.2274 -18.7918
21 C8x C 25.2274 -20.1889
22 C8y C 26.4149 -20.8874
23 C8x C 27.6723 -20.1889
24 C8x C 27.6025 -18.7918
25 O5a O 23.9699 -16.6962
26 N2b N 26.4149 -22.2845 #+
27 O3a O 25.0876 -23.1230 #-
28 O3a O 27.6025 -22.9830
29 X Cl 21.5950 -16.6962
BOND 31
1 9 11 1
2 1 2 1
3 10 12 1
4 1 3 1
5 4 5 1
6 4 3 1
7 3 6 2
8 6 7 1
9 7 8 2
10 8 4 1
11 20 19 1
12 19 17 1
13 17 16 2
14 16 13 1
15 13 14 2
16 14 15 1
17 15 18 2
18 20 21 2
19 21 22 1
20 22 23 2
21 23 24 1
22 24 5 2
23 5 20 1
24 17 18 1
25 19 25 2
26 22 26 1
27 2 9 1
28 26 27 1
29 26 28 2
30 2 10 1
31 16 29 1