KEGG   COMPOUND: C10957
Entry
C10957                      Compound                               
Name
Thifensulfuron-methyl;
Thifensulfuron methyl
Formula
C12H13N5O6S2
Exact mass
387.0307
Mol weight
387.3915
Structure
Brite
Pesticides [BR:br08007]
 Pesticides
  Herbicides
   Sulfonylurea herbicides
    C10957  Thifensulfuron-methyl
Other DBs
CAS: 79277-27-3
PubChem: 13140
ChEBI: 83453
PDB-CCD: R4O[PDBj]
NIKKAJI: J372.958C
LinkDB
KCF data

ATOM        25
            1   C8y C    32.6900  -17.6400
            2   C8y C    32.6900  -16.2400
            3   S2x S    34.0200  -15.8200
            4   C8x C    34.8600  -16.9400
            5   C8x C    34.0200  -18.0600
            6   C8y C    26.6700  -18.3400
            7   N5x N    26.6700  -19.7400
            8   C8y C    25.4800  -20.4400
            9   N5x N    24.2900  -19.7400
            10  C8y C    24.2900  -18.3400
            11  N5x N    25.4800  -17.6400
            12  S4a S    31.5000  -18.3400
            13  N1b N    30.3100  -17.6400
            14  O3c O    32.4800  -19.5300
            15  O3c O    30.5200  -19.5300
            16  C5a C    29.1200  -18.3400
            17  N1b N    27.9300  -17.6400
            18  O2a O    23.1000  -17.6400
            19  C1a C    21.9100  -18.3400
            20  O5a O    29.1200  -19.7400
            21  C1a C    25.4800  -21.8400
            22  C7a C    31.5000  -15.5400
            23  O7a O    30.3100  -16.2400
            24  C1a C    29.1200  -15.5400
            25  O6a O    31.5000  -14.1400
BOND        26
            1     1  12 1
            2    12  13 1
            3     2   3 1
            4    12  14 2
            5     3   4 1
            6    12  15 2
            7     4   5 2
            8    13  16 1
            9     5   1 1
            10   16  17 1
            11   17   6 1
            12    6   7 2
            13   10  18 1
            14    7   8 1
            15   18  19 1
            16    8   9 2
            17   16  20 2
            18    9  10 1
            19    8  21 1
            20   10  11 2
            21    2  22 1
            22   11   6 1
            23   22  23 1
            24   23  24 1
            25    1   2 2
            26   22  25 2

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