|
| ID |
DDInter646 |
| Drug Type |
small molecule |
| Molecular Formula |
C14H15N3O5 |
| Molecular Weight |
305.290
|
| Description |
Entacapone is a selective reversible catechol-O-methyltransferase inhibitor for the treatment of Parkinson's disease.
|
| ATC Classification |
N04BX02
|
| IUPAC Name |
(2E)-2-Cyano-3-(3,4-Dihydroxy-5-Nitrophenyl)-N,N-Diethylprop-2-Enamide |
| InChI |
Inchi=1S/C14H15N3O5/C1-3-16(4-2)14(20)10(8-15)5-9-6-11(17(21)22)13(19)12(18)7-9/H5-7,18-19H,3-4H2,1-2H3/B10-5+ |
| InChI Key |
JRURYQJSLYLRLN-BJMVGYQFSA-N |
| Canonical SMILES |
CCN(CC)C(=O)C(=C\C1=CC(=C(O)C(O)=C1)[N+]([O-])=O)\C#N |
| Useful Links |
DrugBank
ChEMBL
PubChem
|