N-Benzyl-N-(2-cyano-6-trifluoromethyl-phenyl)-4-methoxy-benzenesulfonamide

HCID 17866657
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Basic information

Standard SMILES
COc1ccc(S(=O)(=O)N(Cc2ccccc2)c2c(C#N)cccc2C(F)(F)F)cc1
InChIKey
RDNLQSCPAZURQA-UHFFFAOYSA-N
Molecular formula
C22H17F3N2O3S
Average molar mass
446.4 g/mol
Monoisotopic mass
446.09119807

Names & identifiers

Preferred name
N-Benzyl-N-(2-cyano-6-trifluoromethyl-phenyl)-4-methoxy-benzenesulfonamide
IUPAC
N-benzyl-N-[2-cyano-6-(trifluoromethyl)phenyl]-4-methoxybenzenesulfonamide

Names & synonyms

N-Benzyl-N-(2-cyano-6-trifluoromethyl-phenyl)-4-methoxy-benzenesulfonamideSCHEMBL7321532

Database identifiers

PubChem CID
17866657

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
78.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
6
Heavy atoms
31

Related reactions

3 records
New reaction record

Compound notes

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