Basic information
- Standard SMILES
CN(C)C(=O)c1ccccc1CC(=O)Nc1cccc(/C=C/c2nc(C3CCC3)cs2)c1- InChIKey
FVKJHHCVAIRVMS-BUHFOSPRSA-N- Molecular formula
- C26H27N3O2S
- Average molar mass
- 445.6 g/mol
Names & identifiers
- Preferred name
- (E)-2-[2-[3-[2-[4-(cyclobutyl)-2-thiazolyl]ethenyl]phenylamino]-2-oxoethyl]-N,N-dimethylbenzamide
- IUPAC
- 2-[2-[3-[(E)-2-(4-cyclobutyl-1,3-thiazol-2-yl)ethenyl]anilino]-2-oxoethyl]-N,N-dimethylbenzamide
Names & synonyms
SCHEMBL9259847FVKJHHCVAIRVMS-BUHFOSPRSA-NL009936(E)-2-[2-[3-[2-[4-(cyclobutyl)-2-thiazolyl]ethenyl]phenylamino]-2-oxoethyl]-N,N-dimethylbenzamide
Database identifiers
- PubChem CID
- 20084366
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 90.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 678
Related reactions
2 records
Compound notes
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