Mrv0541 02071409412D          

 11 12  0  0  0  0            999 V2000
   11.6430   -0.4763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9285   -0.8888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9285    0.7612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2140    0.3487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2140   -0.4763    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6430    0.3487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4276   -0.7312    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.9125   -0.0638    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4276    0.6036    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.4996    0.7612    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4996   -0.8888    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  1  2  1  0  0  0  0
  3  4  2  0  0  0  0
 10  4  1  0  0  0  0
  5  4  1  0  0  0  0
  2  5  2  0  0  0  0
 11  5  1  0  0  0  0
  6  1  2  0  0  0  0
  3  6  1  0  0  0  0
  9  6  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
M  END
> <ID>
CHEBI:15890

> <NAME>
5,6-dimethylbenzimidazole

> <DEFINITION>
A dimethylbenzimidazole carrying methyl substituents at positions 5 and 6.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:42126; CHEBI:4620; CHEBI:14172; CHEBI:20516

> <SYNONYM>
Dimezol; Dimethylbenzimidazole; Dimesol; Dimedazole; Dimedazol; 5,6-dimethylbenzimidazole; 5,6-DIMETHYLBENZIMIDAZOLE; 5,6-Dimethylbenzimidazole

> <IUPAC_NAME>
5,6-dimethyl-1H-benzimidazole

> <FORMULA>
C9H10N2

> <MASS>
146.18910

> <MONOISOTOPIC_MASS>
146.08440

> <CHARGE>
0

> <SMILES>
Cc1cc2nc[nH]c2cc1C

> <INCHI>
InChI=1S/C9H10N2/c1-6-3-8-9(4-7(6)2)11-5-10-8/h3-5H,1-2H3,(H,10,11)

> <INCHIKEY>
LJUQGASMPRMWIW-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
116595

> <CAS_REGISTRY_NUMBER>
582-60-5

> <GMELIN_REGISTRY_NUMBER>
279255

> <REAXYS_REGISTRY_NUMBER>
116595

> <CHEMIDPLUS>
582-60-5

> <DRUGBANK_ACCESSION>
DB02591

> <KEGG_COMPOUND_ACCESSION>
C03114

> <METACYC_ACCESSION>
DIMETHYLBENZIMIDAZOLE

> <PDBECHEM_ACCESSION>
DMD

> <WIKIPEDIA_ACCESSION>
Dimethylbenzimidazole

> <PUBMED_CITATION>
23479751

$$$$