KEGG   COMPOUND: C15639
Entry
C15639                      Compound                               
Name
CITCO;
6-(4-Chlorophenyl)imidazo[2,1-b][1,3]thiazole-5-carbaldehyde O-(3,4-dichlorobenzyl)oxime
Formula
C19H12Cl3N3OS
Exact mass
434.9767
Mol weight
436.7421
Structure
Other DBs
CAS: 338404-52-7
PubChem: 17396629
PDB-CCD: CID[PDBj]
NIKKAJI: J1.910.910K
KCF data

ATOM        27
            1   C8y C    19.0244  -26.7418
            2   C8y C    19.0244  -25.4073
            3   C8y C    20.1800  -27.4090
            4   C8x C    21.3357  -26.7418
            5   N2b N    21.3357  -25.4073
            6   C2b C    20.1800  -24.7401
            7   C8x C    20.1800  -28.7434
            8   C8x C    21.3357  -29.4106
            9   C8y C    22.4913  -28.7434
            10  C8x C    22.4913  -27.4090
            11  C1b C    23.6470  -25.4073
            12  O2a O    22.4913  -24.7401
            13  C8x C    25.9583  -25.4073
            14  C8y C    24.8027  -24.7401
            15  C8x C    27.1139  -24.7401
            16  C8y C    27.1139  -23.4057
            17  C8y C    25.9583  -22.7385
            18  C8x C    24.8027  -23.4057
            19  X   Cl   25.9583  -21.4041
            20  X   Cl   28.2931  -22.7245
            21  X   Cl   23.6347  -29.4037
            22  N4y N    17.7552  -24.9950
            23  C8y C    16.9709  -26.0746
            24  N5x N    17.7552  -27.1541
            25  C8x C    16.9708  -23.9155
            26  C8x C    15.7017  -24.3279
            27  S2x S    15.7018  -25.6623
BOND        30
            1     1   2 2
            2     1   3 1
            3     3   4 1
            4     5   6 2
            5     2   6 1
            6     3   7 2
            7     7   8 1
            8     8   9 2
            9     9  10 1
            10   10   4 2
            11   11  12 1
            12    5  12 1
            13   13  14 1
            14   11  14 1
            15   13  15 2
            16   15  16 1
            17   16  17 2
            18   17  18 1
            19   14  18 2
            20   17  19 1
            21   16  20 1
            22    9  21 1
            23    2  22 1
            24   22  23 1
            25   23  24 2
            26    1  24 1
            27   22  25 1
            28   25  26 2
            29   26  27 1
            30   23  27 1

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