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

Systemtic Name: N-[4-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-4-methoxy-benzamide Openeye Name: N-[4-[2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]sulfanylphenyl]-4-methoxy-benzamide CAS Name: N-[4-[[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]thio]phenyl]-4-methoxybenzamide IUPAC Name: N-[4-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanylphenyl]-4-methoxybenzamide Traditional Name: N-[4-[[2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]thio]phenyl]-4-methoxy-benzamide Formula: C22H18BrFN2O3S MolecularWeight: 489.357323

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C22H18BrFN2O3S/c1-29-17-7-2-14(3-8-17)22(28)25-16-5-9-18(10-6-16)30-13-21(27)26-20-11-4-15(23)12-19(20)24/h2-12H,13H2,1H3,(H,25,28)(H,26,27)