Benzamide, N-[4-(2,2-dicyanoethenyl)phenyl]-2-[[(2,5-dimethylphenyl)sulfonyl]amino]-
Basic information
- CAS
1259198-71-4- Standard SMILES
Cc1ccc(C)c(S(=O)(=O)Nc2ccccc2C(=O)Nc2ccc(C=C(C#N)C#N)cc2)c1- InChIKey
AWULPQSXCCAVIK-UHFFFAOYSA-N- Molecular formula
- C25H20N4O3S
- Average molar mass
- 456.5 g/mol
- Monoisotopic mass
- 456.12561169
Names & identifiers
- Preferred name
- Benzamide, N-[4-(2,2-dicyanoethenyl)phenyl]-2-[[(2,5-dimethylphenyl)sulfonyl]amino]-
- IUPAC
- N-[4-(2,2-dicyanoethenyl)phenyl]-2-[(2,5-dimethylphenyl)sulfonylamino]benzamide
Names & synonyms
DTXSID501129393AKOS033110053Benzamide, N-[4-(2,2-dicyanoethenyl)phenyl]-2-[[(2,5-dimethylphenyl)sulfonyl]amino]-1259198-71-4Z1147665721N-[4-(2,2-Dicyanoethenyl)phenyl]-2-[(2,5-dimethylbenzene-1-sulfonyl)amino]benzamide
Database identifiers
- CAS
1259198-71-4- PubChem CID
- 51136200
- DTXSID
DTXSID501129393
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 910
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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