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

Systemtic Name: 2-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(3-methylphenyl)butanamide Openeye Name: 2-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(m-tolyl)butanamide CAS Name: 2-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(3-methylphenyl)butanamide IUPAC Name: 2-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(3-methylphenyl)butanamide Traditional Name: 2-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(m-tolyl)butyramide Formula: C31H29N3O3S MolecularWeight: 523.64526

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)C)SC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=C(C(=CC=C4)OC)OC)C#N

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)C)SC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=C(C(=CC=C4)OC)OC)C#N

InChI

InChI=1S/C31H29N3O3S/c1-5-28(30(35)33-22-14-9-11-20(2)17-22)38-31-25(19-32)24(18-26(34-31)21-12-7-6-8-13-21)23-15-10-16-27(36-3)29(23)37-4/h6-18,28H,5H2,1-4H3,(H,33,35)