2-[3-cyano-4-(4-ethoxy-3-methoxy-phenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-[3-cyano-4-(4-ethoxy-3-methoxy-phenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-[[3-cyano-4-(4-ethoxy-3-methoxy-phenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[[3-cyano-4-(4-ethoxy-3-methoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-[3-cyano-4-(4-ethoxy-3-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(2,6-dimethylphenyl)acetamide Traditional Name: 2-[[3-cyano-4-(4-ethoxy-3-methoxy-phenyl)-6-phenyl-2-pyridyl]thio]-N-(2,6-dimethylphenyl)acetamide Formula: C31H29N3O3S MolecularWeight: 523.64526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3=C(C=CC=C3C)C)C4=CC=CC=C4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3=C(C=CC=C3C)C)C4=CC=CC=C4)OC

InChI

InChI=1S/C31H29N3O3S/c1-5-37-27-15-14-23(16-28(27)36-4)24-17-26(22-12-7-6-8-13-22)33-31(25(24)18-32)38-19-29(35)34-30-20(2)10-9-11-21(30)3/h6-17H,5,19H2,1-4H3,(H,34,35)