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

Systemtic Name: 3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(2-methylquinolin-4-yl)propanamide Openeye Name: 3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(2-methyl-4-quinolyl)propanamide CAS Name: 3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(2-methyl-4-quinolinyl)propanamide IUPAC Name: 3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(2-methylquinolin-4-yl)propanamide Traditional Name: 3-[[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)CCSC3=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)CCSC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=C(C=CC(=C5)OC)OC)C#N

InChI

InChI=1S/C33H28N4O3S/c1-21-17-30(24-11-7-8-12-28(24)35-21)36-32(38)15-16-41-33-27(20-34)25(19-29(37-33)22-9-5-4-6-10-22)26-18-23(39-2)13-14-31(26)40-3/h4-14,17-19H,15-16H2,1-3H3,(H,35,36,38)