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

Systemtic Name: 3-[3-cyano-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(2-methylphenyl)propanamide Openeye Name: 3-[[3-cyano-6-phenyl-4-(3,4,5-trimethoxyphenyl)-2-pyridyl]sulfanyl]-N-(o-tolyl)propanamide CAS Name: 3-[[3-cyano-6-phenyl-4-(3,4,5-trimethoxyphenyl)-2-pyridinyl]thio]-N-(2-methylphenyl)propanamide IUPAC Name: 3-[3-cyano-6-phenyl-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(2-methylphenyl)propanamide Traditional Name: 3-[[3-cyano-6-phenyl-4-(3,4,5-trimethoxyphenyl)-2-pyridyl]thio]-N-(o-tolyl)propionamide Formula: C31H29N3O4S MolecularWeight: 539.64466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CCSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC(=C(C(=C4)OC)OC)OC)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CCSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC(=C(C(=C4)OC)OC)OC)C#N

InChI

InChI=1S/C31H29N3O4S/c1-20-10-8-9-13-25(20)33-29(35)14-15-39-31-24(19-32)23(18-26(34-31)21-11-6-5-7-12-21)22-16-27(36-2)30(38-4)28(17-22)37-3/h5-13,16-18H,14-15H2,1-4H3,(H,33,35)