2-[3-cyano-4-(3-fluorophenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(4-phenyl-1,3-thiazol-2-yl)butanamide

Systemtic Name: 2-[3-cyano-4-(3-fluorophenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(4-phenyl-1,3-thiazol-2-yl)butanamide Openeye Name: 2-[[3-cyano-4-(3-fluorophenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(4-phenylthiazol-2-yl)butanamide CAS Name: 2-[[3-cyano-4-(3-fluorophenyl)-6-phenyl-2-pyridinyl]thio]-N-(4-phenyl-2-thiazolyl)butanamide IUPAC Name: 2-[3-cyano-4-(3-fluorophenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(4-phenyl-1,3-thiazol-2-yl)butanamide Traditional Name: 2-[[3-cyano-4-(3-fluorophenyl)-6-phenyl-2-pyridyl]thio]-N-(4-phenylthiazol-2-yl)butyramide Formula: C31H23FN4OS2 MolecularWeight: 550.668923

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=CS1)C2=CC=CC=C2)SC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC(=CC=C5)F)C#N

Isomeric SMILES

CCC(C(=O)NC1=NC(=CS1)C2=CC=CC=C2)SC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC(=CC=C5)F)C#N

InChI

InChI=1S/C31H23FN4OS2/c1-2-28(29(37)36-31-35-27(19-38-31)21-12-7-4-8-13-21)39-30-25(18-33)24(22-14-9-15-23(32)16-22)17-26(34-30)20-10-5-3-6-11-20/h3-17,19,28H,2H2,1H3,(H,35,36,37)