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2-aminothiazole-4-carboxamide
2-aminothiazole-4-carboxamide ID: B187294
CAS:118452-02-1
Supplier:BEYOND PHARMATECH CORPORATION LIMITED

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SMILES:c1(nc(sc1)N)C(=O)N	
FORMULA: C4H5N3OS
MASS: 143.1670
EXACT MASS: 143.0153328
INTERATOMIC DISTANCES

              C   1      N   2      C   3      C   4      C   5      S   6
              ------------------------------------------------------------------
   C   1    0.0000 
   N   2    0.7426     0.0000 
   C   3    1.2000     0.7426     0.0000 
   C   4    0.7406     1.2004     1.1993     0.0000 
   C   5    0.7497     1.3283     1.9267     1.3288     0.0000 
   S   6    1.2027     1.2017     0.7393     0.7458     1.9304     0.0000 
   O   7    1.2893     1.5525     2.2743     1.9889     0.7404     2.4780 
   N   8    1.9267     1.3283     0.7497     1.9268     2.6250     1.3258 
   N   9    1.2863     1.9873     2.4727     1.5505     0.7402     2.2757 

              O   7      N   8      N   9
              ---------------------------------
   O   7    0.0000 
   N   8    2.8681     0.0000 
   N   9    1.2874     3.2100     0.0000 



ATOMIC CHARGES
   C   1    0.1462635821
   N   2   -0.2167033678
   C   3    0.2007135222
   C   4    0.0620648437
   C   5    0.3024663214
   S   6   -0.0477184933
   O   7   -0.2649817437
   N   8   -0.0997619847
   N   9   -0.0823426798


BOND ANGLES
   2    1    4  Nar  Car  Car    108.069
   2    1    5  Nar  Car   C2    125.771
   4    1    5  Car  Car   C2    126.159
   1    2    3  Car  Nar  Car    107.803
   2    3    8  Nar  Car  Npl    125.771
   2    3    6  Nar  Car   S2    108.379
   6    3    8   S2  Car  Npl    125.850
   1    4    6  Car  Car   S2    108.029
   1    5    7  Car   C2   O2    119.820
   1    5    9  Car   C2  Nam    119.377
   7    5    9   O2   C2  Nam    120.803
   3    6    4  Car   S2  Car    107.719


TORSION ANGLES
   3    2    1    4      0.026
   3    2    1    5    179.974
   8    3    2    1    179.974
   6    3    2    1      0.026
   6    4    1    2      0.026
   6    4    1    5    179.974
   7    5    1    2      0.026
   7    5    1    4    179.974
   9    5    1    2    179.974
   9    5    1    4      0.026
   3    6    4    1      0.026
   2    3    6    4      0.026
   8    3    6    4    179.974