COMPOUND: C22815
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Entry
C22815 Compound
Name
Flualprazolam;
8-Chloro-6-(2-fluorophenyl)-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
Formula
C17H12ClFN4
Exact mass
326.0735
Mol weight
326.75
Structure
Mol file
KCF file
DB search
Brite
Narcotics and psychotropics in Japan [
br08308.html
]
Psychotropics by Cabinet order Article 3 (78 substances)
C22815
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Other DBs
CAS:
28910-91-0
PubChem:
497620170
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KCF data
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ATOM 23
1 C2y C 19.9503 -16.8703
2 C8y C 19.1103 -15.7502
3 C8y C 19.4603 -14.3502
4 N4y N 20.7203 -13.7902
5 N2x N 21.3503 -16.8703
6 C8y C 21.9803 -14.4202
7 C1x C 22.2603 -15.8202
8 C8x C 18.4803 -13.3702
9 C8x C 17.0803 -13.7902
10 C8y C 16.8003 -15.1202
11 C8x C 17.7803 -16.1703
12 X Cl 15.4002 -15.6102
13 C8y C 19.3203 -18.1303
14 C8x C 17.9203 -18.1303
15 C8x C 17.2203 -19.3903
16 C8x C 17.9203 -20.5103
17 C8x C 19.3203 -20.5103
18 C8y C 20.0203 -19.3903
19 X F 21.4203 -19.3903
20 N5x N 22.9604 -13.4402
21 N5x N 22.3303 -12.2502
22 C8y C 20.9303 -12.3902
23 C1a C 20.0203 -11.4102
BOND 26
1 3 4 1
2 1 5 2
3 4 6 1
4 2 3 1
5 5 7 1
6 1 2 1
7 6 7 1
8 3 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 2 11 2
13 10 12 1
14 1 13 1
15 13 14 1
16 14 15 2
17 15 16 1
18 16 17 2
19 17 18 1
20 13 18 2
21 18 19 1
22 6 20 2
23 20 21 1
24 21 22 2
25 4 22 1
26 22 23 1
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