IUPAC name
1-[2-(ethanesulfonyl)ethyl]-2-methyl-5-nitro-1H-imidazole
SMILES
CCS(=O)(=O)CCN1C(C)=NC=C1[N+]([O-])=O
Compound class
Antiprotozoal Agents; Anti-Infective Agents; Alkylating Agents; Antitrichomonal Agents; Alimentary Tract and Metabolism; Antibacterials for Systemic Use; Antiinfectives for Systemic Use; Antiparasitic Products, Insecticides and Repellents; Agents Against Protozoal Diseases; Drugs for Peptic Ulcer and Gastro-Oesophageal Reflux Disease (Gord); Drugs for Acid Related Disorders; Imidazole Derivatives; Nitroimidazole Derivatives; CYP3A4 Inhibitors;
Therapeutic area
For the treatment of trichomoniasis caused by .
Common name
Tinidazole
IUPAC name
1-[2-(ethanesulfonyl)ethyl]-2-methyl-5-nitro-1H-imidazole
SMILES
CCS(=O)(=O)CCN1C(C)=NC=C1[N+]([O-])=O
INCHI
InChI=1S/C8H13N3O4S/c1-3-16(14,15)5-4-10-7(2)9-6-8(10)11(12)13/h6H,3-5H2,1-2H3
FORMULA
C8H13N3O4S
Common name
Tinidazole
IUPAC name
1-[2-(ethanesulfonyl)ethyl]-2-methyl-5-nitro-1H-imidazole
Molecular weight
247.272
clogP
-0.336
clogS
-2.186
HBond Acceptor
5
HBond Donor
0
Total Polar Surface Area
103.77
Number of Rings
1
Rotatable Bond
5
| Drug ID | Common name | Structure CAS | SMILE | Frequency |
|---|---|---|---|---|
| FDBF00283 | BLAH |
|
S(=O)O | 0.0244 |
| FDBF00317 | (dihydroxy-λ3-sulfanyl)methane |
|
C[S](O)O | 0.0141 |
| FDBF00322 | (dihydroxy-λ3-sulfanyl)ethane |
|
C(C)[S](O)O | 0.0055 |
| FDBF02018 | 1,2-dimethyl-5-nitro-imidazole |
|
Cn1c(ncc1N(=O)=O)C | 0.0007 |
| FDBF02019 | 1-methylsulfonylethane |
|
CS(=O)(=O)CC | 0.0017 |
| FDBF02020 | 1-ethyl-2-methyl-5-nitro-imidazole |
|
C(C)n1c(ncc1N(=O)=O)C | 0.0003 |
| FDBF02021 | 1-ethylsulfonylethane |
|
CCS(=O)(=O)CC | 0.0007 |
