2-[4-(4-tert-butylphenyl)-3-cyano-6-phenyl-pyridin-2-yl]sulfanyl-N-(2-phenylphenyl)ethanamide

Systemtic Name: 2-[4-(4-tert-butylphenyl)-3-cyano-6-phenyl-pyridin-2-yl]sulfanyl-N-(2-phenylphenyl)ethanamide Openeye Name: 2-[[4-(4-tert-butylphenyl)-3-cyano-6-phenyl-2-pyridyl]sulfanyl]-N-(2-phenylphenyl)acetamide CAS Name: 2-[[4-(4-tert-butylphenyl)-3-cyano-6-phenyl-2-pyridinyl]thio]-N-(2-phenylphenyl)acetamide IUPAC Name: 2-[4-(4-tert-butylphenyl)-3-cyano-6-phenylpyridin-2-yl]sulfanyl-N-(2-phenylphenyl)acetamide Traditional Name: 2-[[4-(4-tert-butylphenyl)-3-cyano-6-phenyl-2-pyridyl]thio]-N-(2-phenylphenyl)acetamide Formula: C36H31N3OS MolecularWeight: 553.71584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3=CC=CC=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3=CC=CC=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C36H31N3OS/c1-36(2,3)28-20-18-26(19-21-28)30-22-33(27-14-8-5-9-15-27)39-35(31(30)23-37)41-24-34(40)38-32-17-11-10-16-29(32)25-12-6-4-7-13-25/h4-22H,24H2,1-3H3,(H,38,40)