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

Systemtic Name: 2-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(2-ethyl-6-methyl-phenyl)butanamide Openeye Name: 2-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(2-ethyl-6-methyl-phenyl)butanamide CAS Name: 2-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(2-ethyl-6-methylphenyl)butanamide IUPAC Name: 2-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(2-ethyl-6-methylphenyl)butanamide Traditional Name: 2-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(2-ethyl-6-methyl-phenyl)butyramide Formula: C33H33N3O3S MolecularWeight: 551.69842

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(CC)SC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=C(C(=CC=C4)OC)OC)C#N)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(CC)SC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=C(C(=CC=C4)OC)OC)C#N)C

InChI

InChI=1S/C33H33N3O3S/c1-6-22-16-11-13-21(3)30(22)36-32(37)29(7-2)40-33-26(20-34)25(19-27(35-33)23-14-9-8-10-15-23)24-17-12-18-28(38-4)31(24)39-5/h8-19,29H,6-7H2,1-5H3,(H,36,37)