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

Systemtic Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-6-methyl-N-pyridin-4-yl-pyridine-3-carboxamide Openeye Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-6-methyl-N-(4-pyridyl)pyridine-3-carboxamide CAS Name: 2-[(2,4-dimethoxyphenyl)methylthio]-6-methyl-N-pyridin-4-yl-3-pyridinecarboxamide IUPAC Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-6-methyl-N-pyridin-4-ylpyridine-3-carboxamide Traditional Name: 2-[(2,4-dimethoxybenzyl)thio]-6-methyl-N-(4-pyridyl)nicotinamide Formula: C21H21N3O3S MolecularWeight: 395.47474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NC2=CC=NC=C2)SCC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NC2=CC=NC=C2)SCC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H21N3O3S/c1-14-4-7-18(20(25)24-16-8-10-22-11-9-16)21(23-14)28-13-15-5-6-17(26-2)12-19(15)27-3/h4-12H,13H2,1-3H3,(H,22,24,25)