
 OpenBabel04291915483D

 50 50  0  0  0  0  0  0  0  0999 V2000
   -1.0046   -0.9753   -1.5118 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1955   -1.6290   -2.5332 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2931   -3.9813   -6.2100 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3609   -4.5696   -7.1280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1209   -5.2788   -8.2370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1656   -5.8817   -9.1777 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8276   -3.2718   -5.1009 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6253   -2.7683   -4.3153 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1828   -2.2302   -3.4707 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4079   -3.1305   -4.8781 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4460   -3.6694   -5.7190 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9031   -3.5233   -5.4910 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6631   -4.2336   -6.5992 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1201   -4.0874   -6.3712 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9928   -4.6382   -7.2306 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3131   -4.5058   -7.0240 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1858   -5.0566   -7.8834 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7361   -5.7429   -8.9542 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3725   -5.8797   -9.1676 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1362   -6.6899  -10.4317 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6418   -6.8398  -10.6656 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4055   -7.6500  -11.9297 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5061   -4.9242   -7.6768 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5677   -3.4042   -5.3053 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9842   -0.0533   -0.0831 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3142   -0.0533   -0.0831 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -0.7464   -5.2753   -6.6091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7451   -3.8036   -7.5510 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7354   -4.5731   -8.7560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7367   -6.0448   -7.8140 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5786   -5.1515   -9.5809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6756   -6.3576   -9.9219 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1020   -4.1944   -6.5382 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1616   -3.9560   -4.5472 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1616   -2.4850   -5.4900 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4046   -3.8008   -7.5431 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4046   -5.2719   -6.6002 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6488   -5.1633   -8.0498 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6571   -3.9808   -6.2048 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9296   -4.9117   -9.2763 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9296   -6.3828   -8.3335 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5790   -7.6579  -10.3229 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5790   -6.1868  -11.2658 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1990   -5.8718  -10.7743 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1990   -7.3429   -9.8315 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8484   -7.1469  -12.7638 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3536   -7.7555  -12.0943 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8484   -8.6180  -11.8209 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5135   -5.0449   -7.8652 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2578   -2.8731   -4.4765 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  9  1  0  0  0  0
  2  3  1  0  0  0  0
  3  7  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4 27  1  0  0  0  0
  4 28  1  0  0  0  0
  5  6  1  0  0  0  0
  5 29  1  0  0  0  0
  5 30  1  0  0  0  0
  6 31  1  0  0  0  0
  6 32  1  0  0  0  0
  7 10  1  0  0  0  0
  7  8  2  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 11 33  1  0  0  0  0
 12 13  1  0  0  0  0
 12 34  1  0  0  0  0
 12 35  1  0  0  0  0
 13 14  1  0  0  0  0
 13 36  1  0  0  0  0
 13 37  1  0  0  0  0
 14 15  2  0  0  0  0
 14 24  1  0  0  0  0
 15 16  1  0  0  0  0
 15 38  1  0  0  0  0
 16 17  2  0  0  0  0
 16 39  1  0  0  0  0
 17 23  1  0  0  0  0
 17 18  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 40  1  0  0  0  0
 19 41  1  0  0  0  0
 20 21  1  0  0  0  0
 20 42  1  0  0  0  0
 20 43  1  0  0  0  0
 21 22  1  0  0  0  0
 21 44  1  0  0  0  0
 21 45  1  0  0  0  0
 22 46  1  0  0  0  0
 22 47  1  0  0  0  0
 22 48  1  0  0  0  0
 23 24  2  0  0  0  0
 23 49  1  0  0  0  0
 24 50  1  0  0  0  0
 25 26  1  0  0  0  0
M  END
>  <SKU>
A16289

>  <Product Name>
K145 hydrochloride

>  <CAS>
1449240-68-9

>  <M.Wt>
384.9207

>  <Formula>
C18H25ClN2O3S

>  <Synonyms>
SphK2 inhibitor, K 145 hydrochloride, K-145 hydrochloride

>  <URL>
https://www.adooq.com/k145-hydrochloride.html

$$$$
