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

Systemtic Name: 3-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-naphthalen-2-yl-propanamide Openeye Name: 3-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(2-naphthyl)propanamide CAS Name: 3-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(2-naphthalenyl)propanamide IUPAC Name: 3-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-naphthalen-2-ylpropanamide Traditional Name: 3-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(2-naphthyl)propionamide Formula: C33H27N3O3S MolecularWeight: 545.65078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=CC4=CC=CC=C4C=C3)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=CC4=CC=CC=C4C=C3)C5=CC=CC=C5

InChI

InChI=1S/C33H27N3O3S/c1-38-30-14-8-13-26(32(30)39-2)27-20-29(23-10-4-3-5-11-23)36-33(28(27)21-34)40-18-17-31(37)35-25-16-15-22-9-6-7-12-24(22)19-25/h3-16,19-20H,17-18H2,1-2H3,(H,35,37)