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

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-[4-(2-phenylethanoylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-[4-[(2-phenylacetyl)amino]phenyl]sulfanyl-propanamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[[4-[(1-oxo-2-phenylethyl)amino]phenyl]thio]propanamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-[4-[(2-phenylacetyl)amino]phenyl]sulfanylpropanamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-[[4-[(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=C(C=C2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

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

InChI

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