
 3-(2-thienyl)-6-(trifluoromethyl)thieno[3,2-b]pyridine

 24 26  0  0  0  0  0  0  0  0999 V2000
   -1.3796   -0.1253   -0.0423 C   0  0  0  0  0
   -0.8289    1.1346   -0.0525 C   0  0  0  0  0
    0.8778    1.0824   -0.0575 S   0  0  0  0  0
    0.9038   -0.6353   -0.0457 C   0  0  0  0  0
   -0.3804   -1.1444   -0.0383 C   0  0  0  0  0
    2.1735   -1.4600   -0.0436 C   0  0  0  0  0
    3.4253   -0.8748   -0.0515 C   0  0  0  0  0
    4.6940   -2.0142   -0.0467 S   0  0  0  0  0
    3.5987   -3.3326   -0.0337 C   0  0  0  0  0
    2.2697   -2.8990   -0.0335 C   0  0  0  0  0
    1.2314   -3.7857   -0.0241 N   0  0  0  0  0
    1.5520   -5.0942   -0.0151 C   0  0  0  0  0
    2.8364   -5.6073   -0.0144 C   0  0  0  0  0
    3.9009   -4.7035   -0.0242 C   0  0  0  0  0
    3.0736   -7.0856   -0.0035 C   0  0  0  0  0
    3.7802   -7.5068   -1.0879 F   0  0  0  0  0
    3.7837   -7.4900    1.0852 F   0  0  0  0  0
    1.9287   -7.8225    0.0041 F   0  0  0  0  0
   -2.4464   -0.3122   -0.0377 H   0  0  0  0  0
   -1.3459    2.0844   -0.0574 H   0  0  0  0  0
   -0.6184   -2.2004   -0.0303 H   0  0  0  0  0
    3.6740    0.1773   -0.0598 H   0  0  0  0  0
    0.6869   -5.7569   -0.0078 H   0  0  0  0  0
    4.9329   -5.0459   -0.0242 H   0  0  0  0  0
  1  5  1  0  0  0
  1  2  2  0  0  0
  1 19  1  0  0  0
  2  3  1  0  0  0
  2 20  1  0  0  0
  3  4  1  0  0  0
  4  5  2  0  0  0
  4  6  1  0  0  0
  5 21  1  0  0  0
  6 10  1  0  0  0
  6  7  2  0  0  0
  7  8  1  0  0  0
  7 22  1  0  0  0
  8  9  1  0  0  0
  9 10  2  0  0  0
  9 14  1  0  0  0
 10 11  1  0  0  0
 11 12  2  0  0  0
 12 13  1  0  0  0
 12 23  1  0  0  0
 13 14  2  0  0  0
 13 15  1  0  0  0
 14 24  1  0  0  0
 15 18  1  0  0  0
 15 17  1  0  0  0
 15 16  1  0  0  0
M  END

>  <Chemical Name>
3-(2-thienyl)-6-(trifluoromethyl)thieno[3,2-b]pyridine

>  <PubChem CID>
1486485

>  <Formula>
C12H6F3NS2

>  <Molecular Weight>
285.302000

>  <IUPAC Name>
3-thiophen-2-yl-6-(trifluoromethyl)thieno[3,2-b]pyridine

>  <XlogP>
4.2

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
6

>  <Canonical SMILES>
C1=CSC(=C1)C2=CSC3=C2N=CC(=C3)C(F)(F)F

>  <Isomeric SMILES>
C1=CSC(=C1)C2=CSC3=C2N=CC(=C3)C(F)(F)F

>  <InChI Std. ID>
InChI=1S/C12H6F3NS2/c13-12(14,15)7-4-10-11(16-5-7)8(6-18-10)9-2-1-3-17-9/h1-6H

>  <InChI Key>
CHXUVLIATZSHGQ-UHFFFAOYSA-N

