null
  CDK     0225161908
null
 24 27  0  0  0  0  0  0  0  0999 V2000
   -2.7092    1.9200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2967    1.2055    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4717    1.2055    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0592    1.9200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4717    2.6345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2967    2.6345    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0592    3.3489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2342    3.3489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1783    2.6345    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2342    1.9200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0033    2.6345    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4158    3.3489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0033    4.0634    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2408    3.3489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6533    4.0634    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.4783    4.0634    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9633    4.7308    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7479    4.4759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4623    4.8884    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1768    4.4759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1768    3.6509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4623    3.2384    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7479    3.6509    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9633    3.3960    0.0000 N   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  1  0  0  0  0 
  4  5  2  0  0  0  0 
  5  6  1  0  0  0  0 
  6  1  1  0  0  0  0 
  5  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  4  1  0  0  0  0 
  9 11  1  0  0  0  0 
 11 12  1  0  0  0  0 
 12 13  2  0  0  0  0 
 12 14  1  0  0  0  0 
 14 15  1  0  0  0  0 
 15 16  1  0  0  0  0 
 16 17  2  0  0  0  0 
 17 18  1  0  0  0  0 
 18 19  2  0  0  0  0 
 19 20  1  0  0  0  0 
 20 21  2  0  0  0  0 
 21 22  1  0  0  0  0 
 22 23  2  0  0  0  0 
 23 18  1  0  0  0  0 
 23 24  1  0  0  0  0 
 24 16  1  0  0  0  0 
M  END
> <ID>
CHEBI:119815

> <NAME>
2-(1H-benzimidazol-2-ylthio)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide

> <STAR>
2

> <FORMULA>
C17H15N3O3S

> <MASS>
341.386

> <MONOISOTOPIC_MASS>
341.08341

> <CHARGE>
0

> <SMILES>
C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NC4=CC=CC=C4N3

> <INCHI>
InChI=1S/C17H15N3O3S/c21-16(10-24-17-19-12-3-1-2-4-13(12)20-17)18-11-5-6-14-15(9-11)23-8-7-22-14/h1-6,9H,7-8,10H2,(H,18,21)(H,19,20)

> <INCHIKEY>
JKBYSPZCJCSSQW-UHFFFAOYSA-N

> <LINCS_ACCESSION>
LSM-31259

$$$$