Basic information
- Standard SMILES
C/C=C(/C(=O)NCc1ccnc(-c2ccc(OC(F)(F)F)cc2)c1)N(CC)S(=O)(=O)c1ccc(F)cc1- InChIKey
DZFLRURKYMUVAN-LNQJRUQSSA-N- Molecular formula
- C25H23F4N3O4S
- Average molar mass
- 537.5 g/mol
Names & identifiers
- Preferred name
- (Z)-2-[ethyl-(4-fluorophenyl)sulfonyl-amino]-N-[[2-[4-(trifluoromethoxy)phenyl]-4-pyridyl]methyl]but-2-enamide
- IUPAC
- (Z)-2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-[[2-[4-(trifluoromethoxy)phenyl]-4-pyridinyl]methyl]but-2-enamide
Names & synonyms
(Z)-2-[ethyl-(4-fluorophenyl)sulfonyl-amino]-N-[[2-[4-(trifluoromethoxy)phenyl]-4-pyridyl]methyl]but-2-enamideSCHEMBL16004932
Database identifiers
- PubChem CID
- 90384243
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 97 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 877
Related reactions
1 records
Compound notes
Loading…