Basic information
- Standard SMILES
CS(=O)(=O)c1ccc(Cn2ncc(NC(=O)c3ncoc3-c3ccccc3)n2)o1- InChIKey
POOHNUVYZRIAOK-UHFFFAOYSA-N- Molecular formula
- C18H15N5O5S
- Average molar mass
- 413.4 g/mol
Names & identifiers
- Preferred name
- 5-Phenyl-oxazole-4-carboxylic acid [2-(5-methanesulfonyl-furan-2-ylmethyl)-2H-[1,2,3]triazol-4-yl]-amide
- IUPAC
- N-[2-[(5-methylsulfonylfuran-2-yl)methyl]triazol-4-yl]-5-phenyl-1,3-oxazole-4-carboxamide
Names & synonyms
SCHEMBL2328482POOHNUVYZRIAOK-UHFFFAOYSA-N5-Phenyl-oxazole-4-carboxylic acid [2-(5-methanesulfonyl-furan-2-ylmethyl)-2H-[1,2,3]triazol-4-yl]-amide
Database identifiers
- PubChem CID
- 42646522
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 681
Related reactions
2 records
Compound notes
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