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

Systemtic Name: 3-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(2-methylquinolin-4-yl)propanamide Openeye Name: 3-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(2-methyl-4-quinolyl)propanamide CAS Name: 3-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(2-methyl-4-quinolinyl)propanamide IUPAC Name: 3-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(2-methylquinolin-4-yl)propanamide Traditional Name: 3-[[3-cyano-4-(2,3-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/c1-21-18-29(24-12-7-8-14-27(24)35-21)36-31(38)16-17-41-33-26(20-34)25(19-28(37-33)22-10-5-4-6-11-22)23-13-9-15-30(39-2)32(23)40-3/h4-15,18-19H,16-17H2,1-3H3,(H,35,36,38)