KEGG   COMPOUND: C18482Help
Entry
C18482                      Compound                               

Name
Penthiopyrad
Formula
C16H20F3N3OS
Exact mass
359.1279
Mol weight
359.4097
Structure
Mol fileKCF fileDB search
Brite
Pesticides [BR:br08007]
 Pesticides
  Fungicides
   Amide fungicides
    C18482  Penthiopyrad
BRITE hierarchy
Other DBs
CAS: 183675-82-3
PubChem: 124489156
ChEBI: 81777
ChEMBL: CHEMBL2251844
KCF data Show

ATOM        24
            1   S2x S    19.2335  -18.4934
            2   C8y C    19.6753  -19.8219
            3   C8y C    21.0753  -19.8122
            4   C8x C    21.4987  -18.4778
            5   C8x C    20.3604  -17.6627
            6   C1c C    18.4576  -20.5100
            7   C1b C    17.2451  -19.8100
            8   C1c C    16.0327  -20.5100
            9   C1a C    14.8203  -19.8100
            10  C1a C    18.4511  -21.9097
            11  C1a C    16.0327  -21.9100
            12  N1b N    22.2824  -20.5100
            13  C5a C    23.4949  -19.8100
            14  C8y C    24.7260  -20.5210
            15  C8x C    24.3401  -21.8603
            16  N4y N    25.4913  -22.6345
            17  N5x N    26.5834  -21.7789
            18  C8y C    26.1071  -20.4759
            19  C1d C    26.8759  -19.3381
            20  X   F    28.2751  -19.4370
            21  X   F    26.2567  -18.0664
            22  X   F    27.5759  -18.1256
            23  O5a O    23.4950  -18.4102
            24  C1a C    25.5410  -24.0087
BOND        25
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     1   5 1
            6     2   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 1
            10    6  10 1
            11    8  11 1
            12    3  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 1
            18   17  18 2
            19   14  18 1
            20   18  19 1
            21   19  20 1
            22   19  21 1
            23   19  22 1
            24   13  23 2
            25   16  24 1

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