Entry
Name
Pyrithioxine (JAN); Pyritinol (INN)
Formula
C16H20N2O4S2
Exact mass
368.0864
Mol weight
368.48
Structure
Mol file KCF file DB search
Simcomp
Neighbor
Remark
Efficacy
Nootropic
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
N06BX02 Pyritinol
D02160 Pyrithioxine (JAN)
BRITE hierarchy
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KCF data
Show ATOM 24
1 C8y C 19.8822 -15.9610
2 C8y C 19.8822 -17.3604
3 C8y C 21.0950 -18.0601
4 C8y C 22.3079 -17.3604
5 C8x C 22.3079 -15.9610
6 N5x N 21.0950 -15.2612
7 C1b C 23.5207 -18.0601
8 S3a S 24.7336 -17.3604
9 S3a S 25.9464 -18.0601
10 C1b C 27.1593 -17.3604
11 C8y C 28.3721 -18.0601
12 C8y C 28.3721 -19.4596
13 C8y C 29.5850 -20.1593
14 C8y C 30.7978 -19.4596
15 N5x N 30.7978 -18.0601
16 C8x C 29.5850 -17.3604
17 C1b C 27.1593 -20.1593
18 O1a O 29.5850 -21.5587
19 C1a C 32.0107 -20.1593
20 C1b C 21.0950 -19.4596
21 O1a O 27.1593 -21.5587
22 O1a O 19.8822 -20.1593
23 O1a O 18.6693 -18.0601
24 C1a C 18.6693 -15.2612
BOND 25
1 6 1 1
2 4 7 1
3 1 2 2
4 11 12 2
5 12 13 1
6 13 14 2
7 14 15 1
8 15 16 2
9 16 11 1
10 7 8 1
11 12 17 1
12 2 3 1
13 13 18 1
14 8 9 1
15 14 19 1
16 3 4 2
17 3 20 1
18 9 10 1
19 17 21 1
20 4 5 1
21 20 22 1
22 10 11 1
23 2 23 1
24 5 6 2
25 1 24 1