
 OpenBabel04291915453D

 63 63  0  0  1  0  0  0  0  0999 V2000
   16.8245    4.2422   -0.2742 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6364    2.8482    0.3018 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.6429    2.9045    1.4508 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1081    1.9201   -0.7798 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9200    0.5261   -0.2039 C   0  0  3  0  0  0  0  0  0  0  0  0
   14.9265    0.5824    0.9451 C   0  0  3  0  0  0  0  0  0  0  0  0
   14.7384   -0.8116    1.5211 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.1092   -1.9167    0.2331 S   0  0  0  0  0  0  0  0  0  0  0  0
   13.8899   -3.5418    0.9045 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4289   -4.5337    0.1253 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2627   -5.7653    0.6342 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8017   -6.7572   -0.1450 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2517   -3.8360    2.4851 S   0  0  0  0  0  0  0  0  0  0  0  0
   15.4416    1.4873    1.9997 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5227    2.0498    1.8516 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.6973    1.7001    3.1620 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.1612    2.5149    4.1116 O   0  5  0  0  0  0  0  0  0  0  0  0
   15.4048   -0.3787   -1.2585 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.2003    0.0512   -2.3900 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.1520   -1.7204   -0.9650 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.6534   -2.5963   -1.9858 C   0  0  3  0  0  0  0  0  0  0  0  0
   15.6469   -2.6526   -3.1348 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.8302   -1.2934   -3.6964 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6687   -1.1004   -4.7275 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.8349    0.1312   -5.2363 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6734    0.3242   -6.2674 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.8396    1.5558   -6.7763 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1579   -0.2548   -3.1741 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.4700   -3.9555   -1.4242 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.7395   -4.1746   -0.2468 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9906   -4.9869   -2.2345 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.8131   -6.3025   -1.6909 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9757    0.0867    0.0435 Na  0  3  0  0  0 15  0  0  0  0  0  0
   17.5239    4.2026   -1.0830 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.1964    4.8955    0.4872 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.8856    4.6099   -0.6322 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.5753    2.4805    0.6598 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.7040    3.2722    1.0927 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.0149    3.5578    2.2122 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.5105    1.9232    1.8562 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.8074    1.8805   -1.5887 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.1692    2.2878   -1.1379 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.8589    0.1585    0.1542 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.9876    0.9501    0.5871 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.0390   -0.7719    2.3299 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.6773   -1.1792    1.8791 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.2024   -4.3495   -0.8645 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.4893   -5.9495    1.6240 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.4459   -7.4984   -0.7686 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.8303    1.2490    3.2808 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.3160   -2.0652   -0.0576 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.7145   -2.2286   -2.3438 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.2749   -3.3059   -3.8962 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.5858   -3.0203   -2.7768 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.1854   -1.8986   -5.1288 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.3183    0.9293   -4.8350 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.1900   -0.4740   -6.6687 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.2195    2.2798   -7.4059 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.4771    0.0031   -2.4427 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.7745   -4.8111   -3.1788 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.0967   -6.3034   -0.6592 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.4242   -6.9964   -2.2295 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.7859   -6.5891   -1.7787 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 34  1  0  0  0  0
  1 35  1  0  0  0  0
  1 36  1  0  0  0  0
  2  4  1  0  0  0  0
  2  3  1  0  0  0  0
  2 37  1  0  0  0  0
  3 38  1  0  0  0  0
  3 39  1  0  0  0  0
  3 40  1  0  0  0  0
  4  5  1  0  0  0  0
  4 41  1  0  0  0  0
  4 42  1  0  0  0  0
  5 18  1  0  0  0  0
  5  6  1  0  0  0  0
  5 43  1  0  0  0  0
  6 14  1  0  0  0  0
  6  7  1  0  0  0  0
  6 44  1  0  0  0  0
  7  8  1  0  0  0  0
  7 45  1  0  0  0  0
  7 46  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 13  1  0  0  0  0
 10 11  1  0  0  0  0
 10 47  1  0  0  0  0
 11 12  2  0  0  0  0
 11 48  1  0  0  0  0
 12 13  1  0  0  0  0
 12 49  1  0  0  0  0
 14 16  1  0  0  0  0
 14 15  2  0  0  0  0
 16 17  1  0  0  0  0
 16 50  1  0  0  0  0
 18 20  1  0  0  0  0
 18 19  2  0  0  0  0
 20 21  1  0  0  0  0
 20 51  1  0  0  0  0
 21 29  1  0  0  0  0
 21 22  1  0  0  0  0
 21 52  1  0  0  0  0
 22 23  1  0  0  0  0
 22 53  1  0  0  0  0
 22 54  1  0  0  0  0
 23 24  2  0  0  0  0
 23 28  1  0  0  0  0
 24 25  1  0  0  0  0
 24 55  1  0  0  0  0
 25 26  2  0  0  0  0
 25 56  1  0  0  0  0
 26 27  1  0  0  0  0
 26 57  1  0  0  0  0
 27 28  2  0  0  0  0
 27 58  1  0  0  0  0
 28 59  1  0  0  0  0
 29 31  1  0  0  0  0
 29 30  2  0  0  0  0
 31 32  1  0  0  0  0
 31 60  1  0  0  0  0
 32 61  1  0  0  0  0
 32 62  1  0  0  0  0
 32 63  1  0  0  0  0
M  CHG  2  17  -1  33   1
M  END
>  <SKU>
A15326

>  <Product Name>
Batimastat sodium salt

>  <CAS>
130464-84-5

>  <M.Wt>
499.62177

>  <Formula>
C23H30N3NaO4S2

>  <Synonyms>
BB-94 sodium salt, BB 94 sodium salt, BB94 sodium salt

>  <URL>
https://www.adooq.com/batimastat-sodium-salt.html

$$$$
