Basic information
- Standard SMILES
CCOc1cc(C(C)(C)C)c(S(=O)(=O)N(C)C)cc1C1=NC(C)(c2ccc(Cl)cc2)C(C)(c2ccc(Cl)cc2)N1C(=O)Cl- InChIKey
NSUAPQOIKZATBG-UHFFFAOYSA-N- Molecular formula
- C32H36Cl3N3O4S
- Average molar mass
- 665.1 g/mol
Names & identifiers
- Preferred name
- rac-(4S*,5R*)-2-(4-tert-butyl-5-dimethylsulfamoyl-2-ethoxy-phenyl)-4,5-bis-(4-chloro-phenyl)-4,5-dimethyl-4,5-dihydro-imidazole-1-carbonyl chloride
- IUPAC
- 2-[4-tert-butyl-5-(dimethylsulfamoyl)-2-ethoxyphenyl]-4,5-bis(4-chlorophenyl)-4,5-dimethylimidazole-1-carbonyl chloride
Names & synonyms
SCHEMBL3546689NSUAPQOIKZATBG-UHFFFAOYSA-Nrac-(4S*,5R*)-2-(4-tert-butyl-5-dimethylsulfamoyl-2-ethoxy-phenyl)-4,5-bis-(4-chloro-phenyl)-4,5-dimethyl-4,5-dihydro-imidazole-1-carbonyl chloride
Database identifiers
- PubChem CID
- 86612876
Properties
Computed structural properties
- XLogP
- 7.9
- Topological polar surface area
- 87.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 1,140
Related reactions
3 records
Compound notes
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