N-[(1R,2S)-1-bromanyl-1-(4-fluorophenyl)-3-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1R,2S)-1-bromanyl-1-(4-fluorophenyl)-3-oxidanylidene-3-phenyl-propan-2-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1S,2R)-1-benzoyl-2-bromo-2-(4-fluorophenyl)ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1R,2S)-1-bromo-1-(4-fluorophenyl)-3-oxo-3-phenylpropan-2-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1R,2S)-1-bromo-1-(4-fluorophenyl)-3-oxo-3-phenylpropan-2-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1S,2R)-1-benzoyl-2-bromo-2-(4-fluorophenyl)ethyl]-4-methyl-benzenesulfonamide Formula: C22H19BrFNO3S MolecularWeight: 476.358563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C2=CC=C(C=C2)F)Br)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H]([C@@H](C2=CC=C(C=C2)F)Br)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H19BrFNO3S/c1-15-7-13-19(14-8-15)29(27,28)25-21(22(26)17-5-3-2-4-6-17)20(23)16-9-11-18(24)12-10-16/h2-14,20-21,25H,1H3/t20-,21-/m1/s1