3-bromanyl-N-(cyanomethyl)-N-ethyl-4-fluoranyl-1-[3-(trifluoromethyl)phenyl]butane-1-sulfonamide

Systemtic Name: 3-bromanyl-N-(cyanomethyl)-N-ethyl-4-fluoranyl-1-[3-(trifluoromethyl)phenyl]butane-1-sulfonamide Openeye Name: 3-bromo-N-(cyanomethyl)-N-ethyl-4-fluoro-1-[3-(trifluoromethyl)phenyl]butane-1-sulfonamide CAS Name: 3-bromo-N-(cyanomethyl)-N-ethyl-4-fluoro-1-[3-(trifluoromethyl)phenyl]-1-butanesulfonamide IUPAC Name: 3-bromo-N-(cyanomethyl)-N-ethyl-4-fluoro-1-[3-(trifluoromethyl)phenyl]butane-1-sulfonamide Traditional Name: 3-bromo-N-(cyanomethyl)-N-ethyl-4-fluoro-1-[3-(trifluoromethyl)phenyl]butane-1-sulfonamide Formula: C15H17BrF4N2O2S MolecularWeight: 445.270293

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC#N)S(=O)(=O)C(CC(CF)Br)C1=CC(=CC=C1)C(F)(F)F

Isomeric SMILES

CCN(CC#N)S(=O)(=O)C(CC(CF)Br)C1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C15H17BrF4N2O2S/c1-2-22(7-6-21)25(23,24)14(9-13(16)10-17)11-4-3-5-12(8-11)15(18,19)20/h3-5,8,13-14H,2,7,9-10H2,1H3