Marvin  09120712102D          

 13 13  0  0  0  0            999 V2000
   -1.8298   -0.2176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4008   -0.2176    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1153   -0.6301    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5443   -0.6301    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6937    1.0199    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8687    0.1949    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3838    0.8624    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3838   -0.4725    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8298    0.6074    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4008    0.6074    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6937    0.1949    0.0000 S   0  0  3  0  0  0  0  0  0  0  0  0
    1.6937   -0.6301    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5187    0.1949    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  9  1  2  0  0  0  0
  4  1  1  0  0  0  0
  3  1  1  0  0  0  0
 10  7  1  0  0  0  0
  6  7  2  0  0  0  0
  8  6  1  0  0  0  0
  2 10  2  0  0  0  0
  8  2  1  0  0  0  0
  3  2  1  0  0  0  0
 13 11  1  0  0  0  0
  5 11  2  0  0  0  0
  6 11  1  0  0  0  0
 11 12  2  0  0  0  0
M  END
> <ID>
CHEBI:27690

> <NAME>
acetazolamide

> <STAR>
3

> <SECONDARY_ID>
CHEBI:41007; CHEBI:2388; CHEBI:22167; CHEBI:22168

> <SYNONYM>
N-[5-(aminosulfonyl)-1,3,5-thiadiazol-2-yl]acetamide; N-[5-(aminosulfonyl)-1,3,4-thiadiazol-2-yl]acetamide; Diamox; Acetazolamide; 5-acetylamino-1,3,4-thiadiazole-2-sulfonamide; 5-ACETAMIDO-1,3,4-THIADIAZOLE-2-SULFONAMIDE; 2-acetylamino-1,3,4-thiadiazole-5-sulfonamide

> <IUPAC_NAME>
N-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)acetamide

> <INN>
acetazolamidum; acetazolamide; acetazolamida

> <BRAND_NAME>
Glaupax; Diluran; Diacarb; Defiltran

> <FORMULA>
C4H6N4O3S2

> <MASS>
222.24500

> <MONOISOTOPIC_MASS>
221.98813

> <CHARGE>
0

> <SMILES>
CC(=O)Nc1nnc(s1)S(N)(=O)=O

> <INCHI>
InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9)

> <INCHIKEY>
BZKPWHYZMXOIDC-UHFFFAOYSA-N

> <BEILSTEIN_REGISTRY_NUMBER>
212994

> <CAS_REGISTRY_NUMBER>
59-66-5

> <GMELIN_REGISTRY_NUMBER>
365421

> <CHEMIDPLUS>
59-66-5

> <DRUGBANK_ACCESSION>
DB00819

> <KEGG_COMPOUND_ACCESSION>
C06805

> <KEGG_DRUG_ACCESSION>
D00218

> <LINCS_ACCESSION>
LSM-5543

> <NIST_CHEMISTRY_WEBBOOK>
59-66-5

> <PDBECHEM_ACCESSION>
AZM

> <WIKIPEDIA_ACCESSION>
Acetazolamide

$$$$