
 OpenBabel04291915453D

 71 73  0  0  0  0  0  0  0  0999 V2000
    5.0039   -2.2220   -0.4157 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5134   -2.0468   -0.3824 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0988   -2.9058    0.7266 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1025   -2.4724   -1.7174 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8401   -0.6236   -0.1295 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1225   -0.2314   -0.0580 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4185    1.0583    0.1712 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7009    1.4504    0.2427 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6873    0.5529    0.0850 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8537    0.2740    0.0282 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.0914    3.1522    0.5452 S   0  0  0  0  0  0  0  0  0  0  0  0
    9.5037    4.0146   -0.5683 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.5000    3.5794    1.8855 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8040    3.3509    0.5830 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.3555    4.6141    0.8079 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.6892    4.7688    0.8373 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2196    5.9837    1.0525 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5093    6.1334    1.0810 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.2862    5.1082    0.9014 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8426    3.4392    0.5998 N   0  0  0  0  0  0  0  0  0  0  0  0
   17.7202    5.2747    0.9331 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.4971    4.2495    0.7536 N   0  0  0  0  0  0  0  0  0  0  0  0
   19.7868    4.3992    0.7821 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5901    3.3391    0.5964 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.9237    3.4939    0.6259 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.2331    6.4495    1.1412 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.4126    7.0486    1.2390 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9604    8.3033    1.4612 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.8440    9.3194    1.6386 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4048   10.6039    1.8660 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4961    3.7040    0.6509 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.8358    3.8595    0.6805 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6390    2.7994    0.4948 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.9727    2.9542    0.5243 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.7760    1.8942    0.3386 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.1096    2.0490    0.3681 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.3661    5.0743    0.8956 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.5592    6.1392    1.0821 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.1070    7.3939    1.3043 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9751   -0.0954   -0.0167 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5919   -1.6173   -1.1964 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5892   -1.9225    0.5240 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7681   -3.2496   -0.5984 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6841   -2.6063    1.6664 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1614   -2.7825    0.7501 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8630   -3.9334    0.5440 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6904   -1.8677   -2.4981 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8667   -3.5000   -1.9000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1651   -2.3490   -1.6939 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8805   -0.9212   -0.1791 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6604    1.7480    0.2924 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.6590    0.2104    0.0258 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8820    0.6164    0.0875 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.3929    2.5739    0.4461 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.1944    5.3328    0.9474 H   0  0  0  0  0  0  0  0  0  0  0  0
   20.1825    2.4055    0.4311 H   0  0  0  0  0  0  0  0  0  0  0  0
   22.9148    3.2103    0.5775 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.5661    8.5814    0.6241 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.5633    8.2779    2.3448 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.2383    9.0413    2.4757 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.2411    9.3448    0.7549 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.9513   10.5809    2.6671 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.2315    1.8658    0.3295 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.3803    3.8878    0.6896 H   0  0  0  0  0  0  0  0  0  0  0  0
   18.3684    0.9606    0.1733 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.1001    1.7632    0.3193 H   0  0  0  0  0  0  0  0  0  0  0  0
   15.3211    8.1092    1.4292 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.7127    7.6720    0.4672 H   0  0  0  0  0  0  0  0  0  0  0  0
   16.7099    7.3685    2.1879 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9451   -0.0954   -0.0167 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6517   -0.9962   -0.1745 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 41  1  0  0  0  0
  1 42  1  0  0  0  0
  1 43  1  0  0  0  0
  2  5  1  0  0  0  0
  2  4  1  0  0  0  0
  2  3  1  0  0  0  0
  3 44  1  0  0  0  0
  3 45  1  0  0  0  0
  3 46  1  0  0  0  0
  4 47  1  0  0  0  0
  4 48  1  0  0  0  0
  4 49  1  0  0  0  0
  5  6  2  0  0  0  0
  5 10  1  0  0  0  0
  6  7  1  0  0  0  0
  6 50  1  0  0  0  0
  7  8  2  0  0  0  0
  7 51  1  0  0  0  0
  8 11  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 52  1  0  0  0  0
 10 53  1  0  0  0  0
 11 14  1  0  0  0  0
 11 13  2  0  0  0  0
 11 12  2  0  0  0  0
 14 15  1  0  0  0  0
 14 54  1  0  0  0  0
 15 16  2  0  0  0  0
 15 20  1  0  0  0  0
 16 31  1  0  0  0  0
 16 17  1  0  0  0  0
 17 27  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 21  1  0  0  0  0
 19 20  2  0  0  0  0
 21 22  2  0  0  0  0
 21 26  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 23 55  1  0  0  0  0
 24 25  1  0  0  0  0
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 25 26  2  0  0  0  0
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 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 28 58  1  0  0  0  0
 28 59  1  0  0  0  0
 29 30  1  0  0  0  0
 29 60  1  0  0  0  0
 29 61  1  0  0  0  0
 30 62  1  0  0  0  0
 31 32  1  0  0  0  0
 32 33  2  0  0  0  0
 32 37  1  0  0  0  0
 33 34  1  0  0  0  0
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 34 35  2  0  0  0  0
 34 64  1  0  0  0  0
 35 36  1  0  0  0  0
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 37 38  1  0  0  0  0
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 39 67  1  0  0  0  0
 39 68  1  0  0  0  0
 39 69  1  0  0  0  0
 40 70  1  0  0  0  0
 40 71  1  0  0  0  0
M  END
>  <SKU>
A14944

>  <Product Name>
Bosentan Hydrate

>  <CAS>
157212-55-0

>  <M.Wt>
569.62934

>  <Formula>
C27H31N5O7S

>  <Synonyms>
Ro 47-0203

>  <URL>
https://www.adooq.com/bosentan-hydrate.html

$$$$
