6-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-N,N-diethyl-pyridine-3-sulfonamide

Systemtic Name: 6-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-N,N-diethyl-pyridine-3-sulfonamide Openeye Name: 6-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-N,N-diethyl-pyridine-3-sulfonamide CAS Name: 6-[(4-bromo-2-fluorophenyl)methylthio]-N,N-diethyl-3-pyridinesulfonamide IUPAC Name: 6-[(4-bromo-2-fluorophenyl)methylsulfanyl]-N,N-diethylpyridine-3-sulfonamide Traditional Name: 6-[(4-bromo-2-fluoro-benzyl)thio]-N,N-diethyl-pyridine-3-sulfonamide Formula: C16H18BrFN2O2S2 MolecularWeight: 433.358723

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)SCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)SCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C16H18BrFN2O2S2/c1-3-20(4-2)24(21,22)14-7-8-16(19-10-14)23-11-12-5-6-13(17)9-15(12)18/h5-10H,3-4,11H2,1-2H3