Basic information
- Standard SMILES
CCc1nc2cc(C(F)(F)F)c(Cl)cc2n1-c1ccc(CCOC(=O)NS(=O)(=O)c2cccnc2)cc1- InChIKey
TXGVHVLTWGKLLQ-UHFFFAOYSA-N- Molecular formula
- C24H20ClF3N4O4S
- Average molar mass
- 553 g/mol
Names & identifiers
- Preferred name
- 2-{4-[6-chloro-2-ethyl-5-(trifluoromethyl)-1H-benzimidazol-1-yl]phenyl}ethyl 3-pyridinylsulfonylcarbamate
- IUPAC
- 2-[4-[6-chloro-2-ethyl-5-(trifluoromethyl)benzimidazol-1-yl]phenyl]ethyl N-pyridin-3-ylsulfonylcarbamate
Names & synonyms
2-{4-[6-chloro-2-ethyl-5-(trifluoromethyl)-1H-benzimidazol-1-yl]phenyl}ethyl 3-pyridinylsulfonylcarbamateSCHEMBL16260502-{4-[6-chloro-2-ethyl-5-(trifluoromethyl)-1H-benzimidazol -1-yl]phenyl}ethyl3-pyridinylsulfonylcarbamate2-{4-[6-chloro-2-ethyl-5-(trifluoromethyl)-1H-benzimidazol-1-yl]phenyl}ethyl-3-pyridinylsulfonylcarbamate
Database identifiers
- PubChem CID
- 21875896
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 8
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 882
Related reactions
9 records
Compound notes
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