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

Systemtic Name: 2-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(2-methylquinolin-4-yl)propanamide Openeye Name: 2-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(2-methyl-4-quinolyl)propanamide CAS Name: 2-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(2-methyl-4-quinolinyl)propanamide IUPAC Name: 2-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(2-methylquinolin-4-yl)propanamide Traditional Name: 2-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(2-methyl-4-quinolyl)propionamide Formula: C33H28N4O3S MolecularWeight: 560.66542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C(C)SC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=C(C=CC(=C5)OC)OC)C#N

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C(C)SC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=C(C=CC(=C5)OC)OC)C#N

InChI

InChI=1S/C33H28N4O3S/c1-20-16-30(24-12-8-9-13-28(24)35-20)36-32(38)21(2)41-33-27(19-34)25(18-29(37-33)22-10-6-5-7-11-22)26-17-23(39-3)14-15-31(26)40-4/h5-18,21H,1-4H3,(H,35,36,38)