Basic information
- Standard SMILES
CON(C(=O)c1cn(C)nc1C(F)(F)F)C(C)C1CC1c1ccc(Cl)s1- InChIKey
ZJLOONXGVVOKNK-UHFFFAOYSA-N- Molecular formula
- C16H17ClF3N3O2S
- Average molar mass
- 407.8 g/mol
Names & identifiers
- Preferred name
- 1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid {1-[2-(5-chloro-thiophen-2-yl)-cyclopropyl]-ethyl}-methoxy-amide
- IUPAC
- N-[1-[2-(5-chlorothiophen-2-yl)cyclopropyl]ethyl]-N-methoxy-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide
Names & synonyms
1-methyl-3-trifluoromethyl-1H-pyrazole-4-carboxylic acid {1-[2-(5-chloro-thiophen-2-yl)-cyclopropyl]-ethyl}-methoxy-amideSCHEMBL11926869
Database identifiers
- PubChem CID
- 86669065
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 541
Related reactions
2 records
Compound notes
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