3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(2,4-dimethoxyphenyl)propanamide

Systemtic Name: 3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(2,4-dimethoxyphenyl)propanamide Openeye Name: 3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(2,4-dimethoxyphenyl)propanamide CAS Name: 3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(2,4-dimethoxyphenyl)propanamide IUPAC Name: 3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(2,4-dimethoxyphenyl)propanamide Traditional Name: 3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(2,4-dimethoxyphenyl)propionamide Formula: C31H29N3O5S MolecularWeight: 555.64406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=C(C=C(C=C3)OC)OC)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=C(C=C(C=C3)OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C31H29N3O5S/c1-36-21-11-13-28(38-3)24(16-21)23-18-27(20-8-6-5-7-9-20)34-31(25(23)19-32)40-15-14-30(35)33-26-12-10-22(37-2)17-29(26)39-4/h5-13,16-18H,14-15H2,1-4H3,(H,33,35)