3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide

Systemtic Name: 3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide Openeye Name: 3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(4-fluorophenyl)propanamide CAS Name: 3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(4-fluorophenyl)propanamide IUPAC Name: 3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide Traditional Name: 3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(4-fluorophenyl)propionamide Formula: C29H24FN3O3S MolecularWeight: 513.582563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C29H24FN3O3S/c1-35-22-12-13-27(36-2)24(16-22)23-17-26(19-6-4-3-5-7-19)33-29(25(23)18-31)37-15-14-28(34)32-21-10-8-20(30)9-11-21/h3-13,16-17H,14-15H2,1-2H3,(H,32,34)