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

Systemtic Name: N-[4-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-2-fluoranyl-benzamide Openeye Name: N-[4-[2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]sulfanylphenyl]-2-fluoro-benzamide CAS Name: N-[4-[[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]thio]phenyl]-2-fluorobenzamide IUPAC Name: N-[4-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanylphenyl]-2-fluorobenzamide Traditional Name: N-[4-[[2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]thio]phenyl]-2-fluoro-benzamide Formula: C21H15BrF2N2O2S MolecularWeight: 477.321806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15BrF2N2O2S/c22-13-5-10-19(18(24)11-13)26-20(27)12-29-15-8-6-14(7-9-15)25-21(28)16-3-1-2-4-17(16)23/h1-11H,12H2,(H,25,28)(H,26,27)