N-(4-bromanyl-2-fluoranyl-phenyl)-3-[3-cyano-6-(4-methoxyphenyl)-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-3-[3-cyano-6-(4-methoxyphenyl)-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-3-[[3-cyano-6-(4-methoxyphenyl)-4-(p-tolyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-(4-bromo-2-fluorophenyl)-3-[[3-cyano-6-(4-methoxyphenyl)-4-(4-methylphenyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-3-[3-cyano-6-(4-methoxyphenyl)-4-(4-methylphenyl)pyridin-2-yl]sulfanylpropanamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-3-[[3-cyano-6-(4-methoxyphenyl)-4-(p-tolyl)-2-pyridyl]thio]propionamide Formula: C29H23BrFN3O2S MolecularWeight: 576.479223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=C(C=C(C=C3)Br)F)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=C(C=C(C=C3)Br)F)C4=CC=C(C=C4)OC

InChI

InChI=1S/C29H23BrFN3O2S/c1-18-3-5-19(6-4-18)23-16-27(20-7-10-22(36-2)11-8-20)34-29(24(23)17-32)37-14-13-28(35)33-26-12-9-21(30)15-25(26)31/h3-12,15-16H,13-14H2,1-2H3,(H,33,35)