null
  CDK     0224162333
null
 17 18  0  0  0  0  0  0  0  0999 V2000
    1.6738   -0.3404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6738   -1.1654    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9593   -1.5779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2449   -1.1654    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9593   -2.4029    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6268   -2.8879    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3718   -3.6725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5468   -3.6725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2919   -2.8879    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0619   -4.3399    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7586   -4.2537    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2435   -4.9211    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9886   -5.7057    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6560   -6.1907    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3234   -5.7057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1081   -5.9607    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0685   -4.9211    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0 
  2  3  1  0  0  0  0 
  3  4  2  0  0  0  0 
  3  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  5  1  0  0  0  0 
  8 10  1  0  0  0  0 
 10 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
 13 14  1  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  2  0  0  0  0 
 15 17  1  0  0  0  0 
 17 12  1  0  0  0  0 
M  END
> <ID>
CHEBI:109774

> <NAME>
5-[[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)thio]methyl]-2-furancarboxylic acid methyl ester

> <STAR>
2

> <FORMULA>
C9H8N2O3S3

> <MASS>
288.370

> <MONOISOTOPIC_MASS>
287.96971

> <CHARGE>
0

> <SMILES>
COC(=O)C1=CC=C(O1)CSC2=NNC(=S)S2

> <INCHI>
InChI=1S/C9H8N2O3S3/c1-13-7(12)6-3-2-5(14-6)4-16-9-11-10-8(15)17-9/h2-3H,4H2,1H3,(H,10,15)

> <INCHIKEY>
NQKJCPUZVXUGJR-UHFFFAOYSA-N

> <LINCS_ACCESSION>
LSM-21202

$$$$