N-(4-bromanyl-2-fluoranyl-phenyl)-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanyl-propanamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[[3-[(1-oxo-2-phenylethyl)amino]phenyl]thio]propanamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanylpropanamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-[[3-[(2-phenylacetyl)amino]phenyl]thio]propionamide Formula: C23H20BrFN2O2S MolecularWeight: 487.384503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Br)F)SC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Br)F)SC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H20BrFN2O2S/c1-15(23(29)27-21-11-10-17(24)13-20(21)25)30-19-9-5-8-18(14-19)26-22(28)12-16-6-3-2-4-7-16/h2-11,13-15H,12H2,1H3,(H,26,28)(H,27,29)