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

Systemtic Name: 3-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(3-methylphenyl)propanamide Openeye Name: 3-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(m-tolyl)propanamide CAS Name: 3-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(3-methylphenyl)propanamide IUPAC Name: 3-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(3-methylphenyl)propanamide Traditional Name: 3-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(m-tolyl)propionamide Formula: C30H27N3O3S MolecularWeight: 509.61868

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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

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

InChI

InChI=1S/C30H27N3O3S/c1-20-9-7-12-22(17-20)32-28(34)15-16-37-30-25(19-31)24(18-26(33-30)21-10-5-4-6-11-21)23-13-8-14-27(35-2)29(23)36-3/h4-14,17-18H,15-16H2,1-3H3,(H,32,34)