2-[(2,4-dimethoxyphenyl)methylsulfanyl]-N-[2-(hydroxymethyl)-5-methyl-pyridin-4-yl]pyridine-3-carboxamide

Systemtic Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-N-[2-(hydroxymethyl)-5-methyl-pyridin-4-yl]pyridine-3-carboxamide Openeye Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-N-[2-(hydroxymethyl)-5-methyl-4-pyridyl]pyridine-3-carboxamide CAS Name: 2-[(2,4-dimethoxyphenyl)methylthio]-N-[2-(hydroxymethyl)-5-methyl-4-pyridinyl]-3-pyridinecarboxamide IUPAC Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-N-[2-(hydroxymethyl)-5-methylpyridin-4-yl]pyridine-3-carboxamide Traditional Name: 2-[(2,4-dimethoxybenzyl)thio]-N-(5-methyl-2-methylol-4-pyridyl)nicotinamide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1NC(=O)C2=C(N=CC=C2)SCC3=C(C=C(C=C3)OC)OC)CO

Isomeric SMILES

CC1=CN=C(C=C1NC(=O)C2=C(N=CC=C2)SCC3=C(C=C(C=C3)OC)OC)CO

InChI

InChI=1S/C22H23N3O4S/c1-14-11-24-16(12-26)9-19(14)25-21(27)18-5-4-8-23-22(18)30-13-15-6-7-17(28-2)10-20(15)29-3/h4-11,26H,12-13H2,1-3H3,(H,24,25,27)