2-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide

Systemtic Name: 2-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide Openeye Name: 2-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(5-methylisoxazol-3-yl)butanamide CAS Name: 2-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(5-methyl-3-isoxazolyl)butanamide IUPAC Name: 2-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide Traditional Name: 2-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(5-methylisoxazol-3-yl)butyramide Formula: C28H26N4O4S MolecularWeight: 514.59544

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NOC(=C1)C)SC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=C(C=CC(=C4)OC)OC)C#N

Isomeric SMILES

CCC(C(=O)NC1=NOC(=C1)C)SC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=C(C=CC(=C4)OC)OC)C#N

InChI

InChI=1S/C28H26N4O4S/c1-5-25(27(33)31-26-13-17(2)36-32-26)37-28-22(16-29)20(15-23(30-28)18-9-7-6-8-10-18)21-14-19(34-3)11-12-24(21)35-4/h6-15,25H,5H2,1-4H3,(H,31,32,33)