N-[3-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]-4-methyl-benzamide

Systemtic Name: N-[3-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]-4-methyl-benzamide Openeye Name: N-[3-[2-(4-bromo-2-fluoro-anilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]-4-methyl-benzamide CAS Name: N-[3-[[2-(4-bromo-2-fluoroanilino)-2-oxo-1-phenylethyl]thio]phenyl]-4-methylbenzamide IUPAC Name: N-[3-[2-(4-bromo-2-fluoroanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]-4-methylbenzamide Traditional Name: N-[3-[[2-(4-bromo-2-fluoro-anilino)-2-keto-1-phenyl-ethyl]thio]phenyl]-4-methyl-benzamide Formula: C28H22BrFN2O2S MolecularWeight: 549.453883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C28H22BrFN2O2S/c1-18-10-12-20(13-11-18)27(33)31-22-8-5-9-23(17-22)35-26(19-6-3-2-4-7-19)28(34)32-25-15-14-21(29)16-24(25)30/h2-17,26H,1H3,(H,31,33)(H,32,34)