N-(2-bromanyl-4-methyl-phenyl)-2-[3-cyano-6-(4-fluorophenyl)-4-phenyl-pyridin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[3-cyano-6-(4-fluorophenyl)-4-phenyl-pyridin-2-yl]sulfanyl-ethanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[[3-cyano-6-(4-fluorophenyl)-4-phenyl-2-pyridyl]sulfanyl]acetamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[[3-cyano-6-(4-fluorophenyl)-4-phenyl-2-pyridinyl]thio]acetamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[3-cyano-6-(4-fluorophenyl)-4-phenylpyridin-2-yl]sulfanylacetamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[[3-cyano-6-(4-fluorophenyl)-4-phenyl-2-pyridyl]thio]acetamide Formula: C27H19BrFN3OS MolecularWeight: 532.426663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)F)C4=CC=CC=C4)C#N)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)F)C4=CC=CC=C4)C#N)Br

InChI

InChI=1S/C27H19BrFN3OS/c1-17-7-12-24(23(28)13-17)31-26(33)16-34-27-22(15-30)21(18-5-3-2-4-6-18)14-25(32-27)19-8-10-20(29)11-9-19/h2-14H,16H2,1H3,(H,31,33)