3-[3-cyano-4-(4-methylphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(2,5-dimethoxyphenyl)propanamide

Systemtic Name: 3-[3-cyano-4-(4-methylphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(2,5-dimethoxyphenyl)propanamide Openeye Name: 3-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(2,5-dimethoxyphenyl)propanamide CAS Name: 3-[[3-cyano-4-(4-methylphenyl)-6-phenyl-2-pyridinyl]thio]-N-(2,5-dimethoxyphenyl)propanamide IUPAC Name: 3-[3-cyano-4-(4-methylphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(2,5-dimethoxyphenyl)propanamide Traditional Name: 3-[[3-cyano-6-phenyl-4-(p-tolyl)-2-pyridyl]thio]-N-(2,5-dimethoxyphenyl)propionamide Formula: C30H27N3O3S MolecularWeight: 509.61868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=C(C=CC(=C3)OC)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=C(C=CC(=C3)OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C30H27N3O3S/c1-20-9-11-21(12-10-20)24-18-26(22-7-5-4-6-8-22)33-30(25(24)19-31)37-16-15-29(34)32-27-17-23(35-2)13-14-28(27)36-3/h4-14,17-18H,15-16H2,1-3H3,(H,32,34)