Basic information
- Standard SMILES
CCc1nc(-c2ccccc2)cn1-c1ccc(CCNC(=O)NS(=O)(=O)c2ccc(C#N)cc2)cc1- InChIKey
AGSVLPWJZDYDKF-UHFFFAOYSA-N- Molecular formula
- C27H25N5O3S
- Average molar mass
- 499.6 g/mol
Names & identifiers
- Preferred name
- 4-cyano-N-[({2-[4-(2-ethyl-4-phenyl-1H-imidazol-1-yl)phenyl]ethyl}amino)carbonyl]benzenesulfonamide
- IUPAC
- 1-(4-cyanophenyl)sulfonyl-3-[2-[4-(2-ethyl-4-phenylimidazol-1-yl)phenyl]ethyl]urea
Names & synonyms
SCHEMBL6175106AGSVLPWJZDYDKF-UHFFFAOYSA-N4-cyano-N-[({2-[4-(2-ethyl-4-phenyl-1H-imidazol-1-yl)phenyl]ethyl}amino)carbonyl]benzenesulfonamide
Database identifiers
- PubChem CID
- 22291395
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 860
Related reactions
2 records
Compound notes
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