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Basic information
- Standard SMILES
CC(C)C(=NO)c1cc(S(=O)(=O)N(C)CCc2ccc(F)cc2)cs1- InChIKey
SSRAAHQAVWEDKM-UHFFFAOYSA-N- Molecular formula
- C17H21FN2O3S2
- Average molar mass
- 384.5 g/mol
- Monoisotopic mass
- 384.09776305
Names & identifiers
- Preferred name
- 5-(1-Hydroxyimino-2-methylpropyl)thiophene-3-sulfonic acid [2-(4-fluorophenyl)-ethyl]-methyl-amide
- IUPAC
- N-[2-(4-fluorophenyl)ethyl]-5-(N-hydroxy-C-propan-2-ylcarbonimidoyl)-N-methylthiophene-3-sulfonamide
Names & synonyms
SSRAAHQAVWEDKM-UHFFFAOYSA-N5-(1-Hydroxyimino-2-methylpropyl)thiophene-3-sulfonic acid [2-(4-fluorophenyl)-ethyl]-methyl-amide
Database identifiers
- PubChem CID
- 86601002
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 555
Related reactions
2 records
Compound notes
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