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

Systemtic Name: 3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(3,5-dimethylphenyl)propanamide Openeye Name: 3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(3,5-dimethylphenyl)propanamide CAS Name: 3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(3,5-dimethylphenyl)propanamide IUPAC Name: 3-[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(3,5-dimethylphenyl)propanamide Traditional Name: 3-[[3-cyano-4-(2,5-dimethoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(3,5-dimethylphenyl)propionamide Formula: C31H29N3O3S MolecularWeight: 523.64526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CCSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=C(C=CC(=C4)OC)OC)C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CCSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=C(C=CC(=C4)OC)OC)C#N)C

InChI

InChI=1S/C31H29N3O3S/c1-20-14-21(2)16-23(15-20)33-30(35)12-13-38-31-27(19-32)25(18-28(34-31)22-8-6-5-7-9-22)26-17-24(36-3)10-11-29(26)37-4/h5-11,14-18H,12-13H2,1-4H3,(H,33,35)