2-[(2,4-dimethoxyphenyl)methylsulfanyl]-6-phenyl-N-pyridin-4-yl-pyridine-3-carboxamide

Systemtic Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-6-phenyl-N-pyridin-4-yl-pyridine-3-carboxamide Openeye Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-6-phenyl-N-(4-pyridyl)pyridine-3-carboxamide CAS Name: 2-[(2,4-dimethoxyphenyl)methylthio]-6-phenyl-N-pyridin-4-yl-3-pyridinecarboxamide IUPAC Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-6-phenyl-N-pyridin-4-ylpyridine-3-carboxamide Traditional Name: 2-[(2,4-dimethoxybenzyl)thio]-6-phenyl-N-(4-pyridyl)nicotinamide Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CSC2=C(C=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC=NC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CSC2=C(C=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC=NC=C4)OC

InChI

InChI=1S/C26H23N3O3S/c1-31-21-9-8-19(24(16-21)32-2)17-33-26-22(25(30)28-20-12-14-27-15-13-20)10-11-23(29-26)18-6-4-3-5-7-18/h3-16H,17H2,1-2H3,(H,27,28,30)