Marvin  07090717142D          

 15 17  0  0  0  0            999 V2000
    0.1474    0.8800    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1474   -0.7700    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5670   -0.3575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5670    0.4675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8619    0.4675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8619   -0.3575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2815    0.8800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2815   -0.7700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9960   -0.3575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9960    0.4675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6465   -0.6124    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.1314    0.0550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6465    0.7224    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.9564    0.0550    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7105   -0.7700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  4  1  2  0  0  0  0
  5  1  1  0  0  0  0
  3  2  2  0  0  0  0
  6  2  1  0  0  0  0
  4  3  1  0  0  0  0
  8  3  1  0  0  0  0
  7  4  1  0  0  0  0
  6  5  2  0  0  0  0
 13  5  1  0  0  0  0
 11  6  1  0  0  0  0
 10  7  2  0  0  0  0
  9  8  2  0  0  0  0
 10  9  1  0  0  0  0
 12 11  1  0  0  0  0
 13 12  1  0  0  0  0
 14 12  2  0  0  0  0
 15  9  1  0  0  0  0
M  END
> <ID>
CHEBI:34620

> <NAME>
quinomethionate

> <DEFINITION>
A dithioloquinoxaline that results from the formal condensation of 6-methylquinoxaline-2,3-dithiol with phosgene. It has been used as a fungicide and acaricide for the control of mites and powdery mildew on citrus, vegetables, and walnuts, but is not approved for use in the EU.

> <STAR>
3

> <SYNONYM>
S,S-(6-methylquinoxaline-2,3-diyl) dithiocarbonate; Quinomethionate; oxythioquinox; chinomethionate; Chinomethionat; 6-Methyl-2,3-quinoxalinedithiol cyclic S,S-dithiocarbonate; 6-methyl-2,3-quinoxalinedithiol cyclic dithiocarbonate

> <IUPAC_NAME>
6-methyl[1,3]dithiolo[4,5-b]quinoxalin-2-one

> <BRAND_NAME>
Morestan

> <FORMULA>
C10H6N2OS2

> <MASS>
234.29952

> <MONOISOTOPIC_MASS>
233.99216

> <CHARGE>
0

> <SMILES>
Cc1ccc2nc3sc(=O)sc3nc2c1

> <INCHI>
InChI=1S/C10H6N2OS2/c1-5-2-3-6-7(4-5)12-9-8(11-6)14-10(13)15-9/h2-4H,1H3

> <INCHIKEY>
FBQQHUGEACOBDN-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
526833

> <CAS_REGISTRY_NUMBER>
2439-01-2

> <REAXYS_REGISTRY_NUMBER>
526833

> <CHEMIDPLUS>
2439-01-2

> <KEGG_COMPOUND_ACCESSION>
C14514

> <NIST_CHEMISTRY_WEBBOOK>
2439-01-2

> <PESTICIDES_ACCESSION>
chinomethionat

> <AGRICOLA_CITATION>
IND84001481; IND84001482

> <PUBMED_CITATION>
1009998; 14505671; 6658821

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