KEGG   COMPOUND: C17931
Entry
C17931                      Compound                               
Name
Imetit
Formula
C6H10N4S
Exact mass
170.0626
Mol weight
170.2354
Structure
Pathway
map07227  Histamine H2/H3 receptor agonists/antagonists
Other DBs
CAS: 102203-18-9
PubChem: 96024152
ChEBI: 64156
PDB-CCD: ITF[PDBj]
NIKKAJI: J506.341H
LinkDB
KCF data

ATOM        11
            1   N4x N    21.7000  -15.2600
            2   C8x C    22.1200  -16.5900
            3   C8y C    23.5200  -16.5900
            4   N5x N    23.9400  -15.2600
            5   C8x C    22.8200  -14.4200
            6   C1b C    24.7100  -17.2900
            7   C1b C    25.9700  -16.5900
            8   S2a S    27.1600  -17.2900
            9   C2c C    28.3500  -16.5900
            10  N1a N    29.6100  -17.2900
            11  N2a N    28.3500  -15.1900
BOND        11
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     1   5 1
            6     3   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    9  11 2

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