KEGG   DRUG: Tinoridine
Entry
D08602                      Drug                                   
Name
Tinoridine (INN)
Formula
C17H20N2O2S
Exact mass
316.1245
Mol weight
316.42
Structure
Simcomp
Efficacy
Analgesic, Anti-inflammatory
Other DBs
CAS: 24237-54-5
PubChem: 96025286
LigandBox: D08602
NIKKAJI: J16.395C
LinkDB
KCF data

ATOM        22
            1   C8x C    18.0600  -16.3100
            2   C8x C    18.0600  -17.7100
            3   C8x C    19.2500  -18.4100
            4   C8x C    20.5100  -17.7100
            5   C8y C    20.5100  -16.3100
            6   C8x C    19.2500  -15.6100
            7   C1b C    21.7000  -15.6100
            8   N1y N    22.8900  -16.3100
            9   C1x C    22.8900  -17.7100
            10  C1x C    24.1500  -18.4100
            11  C1x C    24.0800  -15.6100
            12  C8y C    25.3400  -16.3100
            13  C8y C    25.3400  -17.7100
            14  C8y C    26.6700  -18.1300
            15  C8y C    27.5100  -17.0100
            16  S2x S    26.6700  -15.8900
            17  N1a N    28.9100  -17.0100
            18  C7a C    26.6700  -19.5300
            19  O6a O    25.4100  -20.2300
            20  O7a O    27.8600  -20.2300
            21  C1b C    29.0500  -19.5300
            22  C1a C    30.2400  -20.2300
BOND        24
            1    10  13 1
            2    12  11 1
            3    11   8 1
            4     4   5 1
            5     5   6 2
            6     6   1 1
            7     5   7 1
            8    12  13 2
            9    13  14 1
            10   14  15 2
            11   15  16 1
            12   16  12 1
            13   15  17 1
            14    7   8 1
            15    1   2 2
            16    2   3 1
            17    3   4 2
            18    8   9 1
            19    9  10 1
            20   14  18 1
            21   18  19 2
            22   18  20 1
            23   20  21 1
            24   21  22 1

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