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

Systemtic Name: 2-[3-cyano-4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(2-methyl-4-nitro-phenyl)propanamide Openeye Name: 2-[[3-cyano-4-(3,4-dimethoxyphenyl)-6-(p-tolyl)-2-pyridyl]sulfanyl]-N-(2-methyl-4-nitro-phenyl)propanamide CAS Name: 2-[[3-cyano-4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)-2-pyridinyl]thio]-N-(2-methyl-4-nitrophenyl)propanamide IUPAC Name: 2-[3-cyano-4-(3,4-dimethoxyphenyl)-6-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide Traditional Name: 2-[[3-cyano-4-(3,4-dimethoxyphenyl)-6-(p-tolyl)-2-pyridyl]thio]-N-(2-methyl-4-nitro-phenyl)propionamide Formula: C31H28N4O5S MolecularWeight: 568.64282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC(=C(C=C3)OC)OC)C#N)SC(C)C(=O)NC4=C(C=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC(=C(C=C3)OC)OC)C#N)SC(C)C(=O)NC4=C(C=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C31H28N4O5S/c1-18-6-8-21(9-7-18)27-16-24(22-10-13-28(39-4)29(15-22)40-5)25(17-32)31(34-27)41-20(3)30(36)33-26-12-11-23(35(37)38)14-19(26)2/h6-16,20H,1-5H3,(H,33,36)