N-[4-[(E)-3-(4-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-[(E)-3-(4-bromanyl-2-fluoranyl-phenyl)prop-2-enoyl]phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-[(E)-3-(4-bromo-2-fluoro-phenyl)prop-2-enoyl]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-[(E)-3-(4-bromo-2-fluorophenyl)-1-oxoprop-2-enyl]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-[(E)-3-(4-bromo-2-fluorophenyl)prop-2-enoyl]phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-[(E)-3-(4-bromo-2-fluoro-phenyl)acryloyl]phenyl]-4-methyl-benzenesulfonamide Formula: C22H17BrFNO3S MolecularWeight: 474.342683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)C=CC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)/C=C/C3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C22H17BrFNO3S/c1-15-2-11-20(12-3-15)29(27,28)25-19-9-5-17(6-10-19)22(26)13-7-16-4-8-18(23)14-21(16)24/h2-14,25H,1H3/b13-7+