
 OpenBabel04291915433D

 27 28  0  0  0  0  0  0  0  0999 V2000
    5.5656    1.1650    0.3981 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3116    0.4176    0.1428 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3633   -0.8530   -0.2890 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2269   -1.5303   -0.5203 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2786   -2.8008   -0.9521 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4666   -3.3941   -1.1526 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1236    1.0109    0.3433 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7792   -3.6945   -1.2573 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.9642   -3.7756    0.0304 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9665   -2.9736   -2.3291 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1698   -5.3311   -1.8132 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1834   -6.1936   -2.1073 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4794   -7.4339   -2.5286 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4930   -8.2964   -2.8227 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3678   -5.6840   -1.9320 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8008   -9.5862   -3.2608 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.9318   -9.9194   -3.3729 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1552  -10.4221   -3.5458 O   0  5  0  0  0  0  0  0  0  0  0  0
    6.4050    0.5365    0.1853 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5978    1.4679    1.4238 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5994    2.0302   -0.2306 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2762   -1.3089   -0.4431 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3140   -1.0743   -0.3662 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1182   -4.1520   -1.4095 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4720    1.7688    0.6002 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1979   -5.9033   -2.0096 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4649   -7.7242   -2.6263 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 19  1  0  0  0  0
  1 20  1  0  0  0  0
  1 21  1  0  0  0  0
  2  3  2  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  3 22  1  0  0  0  0
  4  5  2  0  0  0  0
  4 23  1  0  0  0  0
  5  8  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 24  1  0  0  0  0
  7 25  1  0  0  0  0
  8 11  1  0  0  0  0
  8 10  2  0  0  0  0
  8  9  2  0  0  0  0
 11 12  2  0  0  0  0
 11 15  1  0  0  0  0
 12 13  1  0  0  0  0
 12 26  1  0  0  0  0
 13 14  2  0  0  0  0
 13 27  1  0  0  0  0
 14 16  1  0  0  0  0
 14 15  1  0  0  0  0
 16 18  1  0  0  0  0
 16 17  2  0  0  0  0
M  CHG  2  16   1  18  -1
M  END
>  <SKU>
A14068

>  <Product Name>
NSC697923

>  <CAS>
343351-67-7

>  <M.Wt>
267.25786

>  <Formula>
C11H9NO5S

>  <Synonyms>
NSC 697923

>  <URL>
https://www.adooq.com/nsc697923.html

$$$$
