N-[3-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[3-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]-2,6-dimethoxy-benzamide Openeye Name: N-[3-[2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]sulfanylphenyl]-2,6-dimethoxy-benzamide CAS Name: N-[3-[[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]thio]phenyl]-2,6-dimethoxybenzamide IUPAC Name: N-[3-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanylphenyl]-2,6-dimethoxybenzamide Traditional Name: N-[3-[[2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]thio]phenyl]-2,6-dimethoxy-benzamide Formula: C23H20BrFN2O4S MolecularWeight: 519.383303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20BrFN2O4S/c1-30-19-7-4-8-20(31-2)22(19)23(29)26-15-5-3-6-16(12-15)32-13-21(28)27-18-10-9-14(24)11-17(18)25/h3-12H,13H2,1-2H3,(H,26,29)(H,27,28)