2-[3-cyano-6-(4-ethoxyphenyl)-4-phenyl-pyridin-2-yl]sulfanyl-N-(2-ethyl-6-methyl-phenyl)ethanamide

Systemtic Name: 2-[3-cyano-6-(4-ethoxyphenyl)-4-phenyl-pyridin-2-yl]sulfanyl-N-(2-ethyl-6-methyl-phenyl)ethanamide Openeye Name: 2-[[3-cyano-6-(4-ethoxyphenyl)-4-phenyl-2-pyridyl]sulfanyl]-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: 2-[[3-cyano-6-(4-ethoxyphenyl)-4-phenyl-2-pyridinyl]thio]-N-(2-ethyl-6-methylphenyl)acetamide IUPAC Name: 2-[3-cyano-6-(4-ethoxyphenyl)-4-phenylpyridin-2-yl]sulfanyl-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: 2-[(3-cyano-4-phenyl-6-p-phenetyl-2-pyridyl)thio]-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C31H29N3O2S MolecularWeight: 507.64586

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)OCC)C4=CC=CC=C4)C#N)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)OCC)C4=CC=CC=C4)C#N)C

InChI

InChI=1S/C31H29N3O2S/c1-4-22-13-9-10-21(3)30(22)34-29(35)20-37-31-27(19-32)26(23-11-7-6-8-12-23)18-28(33-31)24-14-16-25(17-15-24)36-5-2/h6-18H,4-5,20H2,1-3H3,(H,34,35)