null
  CDK     0224162329
null
 17 19  0  0  0  0  0  0  0  0999 V2000
    0.2196    3.1970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0446    3.1970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4571    2.4826    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2821    2.4826    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.6946    1.7681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5196    1.7681    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9321    1.0536    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5196    0.3391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0717   -0.2740    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8253    0.0616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7391    0.8821    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.6946    0.3391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1426   -0.2740    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3889    0.0616    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6745   -0.3509    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4752    0.8821    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2821    1.0536    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  1  0  0  0  0 
  4  5  1  0  0  0  0 
  5  6  2  0  0  0  0 
  6  7  1  0  0  0  0 
  7  8  2  0  0  0  0 
  8  9  1  0  0  0  0 
  9 10  2  0  0  0  0 
 10 11  1  0  0  0  0 
 11  7  1  0  0  0  0 
  8 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  2  0  0  0  0 
 14 16  1  0  0  0  0 
 16 17  1  0  0  0  0 
 17 12  1  0  0  0  0 
 17  5  1  0  0  0  0 
M  END
> <ID>
CHEBI:105549

> <NAME>
LSM-16912

> <STAR>
2

> <FORMULA>
C11H9N3OS2

> <MASS>
263.341

> <MONOISOTOPIC_MASS>
263.01870

> <CHARGE>
0

> <SMILES>
C=CCSC1=NC2=C(C=CS2)C3=NC(=O)CN31

> <INCHI>
InChI=1S/C11H9N3OS2/c1-2-4-17-11-13-10-7(3-5-16-10)9-12-8(15)6-14(9)11/h2-3,5H,1,4,6H2

> <INCHIKEY>
UJHBLSGKRDPGGZ-UHFFFAOYSA-N

> <LINCS_ACCESSION>
LSM-16912

$$$$