N-(4-bromanyl-2-fluoranyl-phenyl)-2-[3-(2-phenoxyethanoylamino)phenyl]sulfanyl-butanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-[3-(2-phenoxyethanoylamino)phenyl]sulfanyl-butanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-[3-[(2-phenoxyacetyl)amino]phenyl]sulfanyl-butanamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[[3-[(1-oxo-2-phenoxyethyl)amino]phenyl]thio]butanamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-[3-[(2-phenoxyacetyl)amino]phenyl]sulfanylbutanamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-[[3-[(2-phenoxyacetyl)amino]phenyl]thio]butyramide Formula: C24H22BrFN2O3S MolecularWeight: 517.410483

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C=C1)Br)F)SC2=CC=CC(=C2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C=C1)Br)F)SC2=CC=CC(=C2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C24H22BrFN2O3S/c1-2-22(24(30)28-21-12-11-16(25)13-20(21)26)32-19-10-6-7-17(14-19)27-23(29)15-31-18-8-4-3-5-9-18/h3-14,22H,2,15H2,1H3,(H,27,29)(H,28,30)