Basic information
- Standard SMILES
Cc1noc(C)c1COc1ccc(S(=O)(=O)Nc2ccc(C#N)cn2)cc1- InChIKey
GCOZBTKHNRWTPG-UHFFFAOYSA-N- Molecular formula
- C18H16N4O4S
- Average molar mass
- 384.4 g/mol
Names & identifiers
- Preferred name
- N-(5-cyanopyridin-2-yl)-4-((3,5-dimethylisoxazol-4-yl)methoxy)benzenesulfonamide
- IUPAC
- N-(5-cyano-2-pyridinyl)-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzenesulfonamide
Names & synonyms
SCHEMBL15352918GCOZBTKHNRWTPG-UHFFFAOYSA-NN-(5-cyano-2-pyridinyl)-4-{[(3,5-dimethyl-4-isoxazolyl)methyl]oxy}benzenesulfonamideN-(5-cyanopyridin-2-yl)-4-((3,5-dimethylisoxazol-4-yl)methoxy)benzenesulfonamide
Database identifiers
- PubChem CID
- 89876006
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 635
Related reactions
2 records
Compound notes
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