2-[3-cyano-6-(4-methoxyphenyl)-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(2-methylquinolin-4-yl)propanamide

Systemtic Name: 2-[3-cyano-6-(4-methoxyphenyl)-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(2-methylquinolin-4-yl)propanamide Openeye Name: 2-[[3-cyano-6-(4-methoxyphenyl)-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(2-methyl-4-quinolyl)propanamide CAS Name: 2-[[3-cyano-6-(4-methoxyphenyl)-4-(4-methylphenyl)-2-pyridinyl]thio]-N-(2-methyl-4-quinolinyl)propanamide IUPAC Name: 2-[3-cyano-6-(4-methoxyphenyl)-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(2-methylquinolin-4-yl)propanamide Traditional Name: 2-[[3-cyano-6-(4-methoxyphenyl)-4-(p-tolyl)-2-pyridyl]thio]-N-(2-methyl-4-quinolyl)propionamide Formula: C33H28N4O2S MolecularWeight: 544.66602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SC(C)C(=O)NC3=CC(=NC4=CC=CC=C43)C)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SC(C)C(=O)NC3=CC(=NC4=CC=CC=C43)C)C5=CC=C(C=C5)OC

InChI

InChI=1S/C33H28N4O2S/c1-20-9-11-23(12-10-20)27-18-30(24-13-15-25(39-4)16-14-24)37-33(28(27)19-34)40-22(3)32(38)36-31-17-21(2)35-29-8-6-5-7-26(29)31/h5-18,22H,1-4H3,(H,35,36,38)