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

Systemtic Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-6-(methylamino)-N-pyridin-4-yl-pyridine-3-carboxamide Openeye Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-6-(methylamino)-N-(4-pyridyl)pyridine-3-carboxamide CAS Name: 2-[(2,4-dimethoxyphenyl)methylthio]-6-(methylamino)-N-pyridin-4-yl-3-pyridinecarboxamide IUPAC Name: 2-[(2,4-dimethoxyphenyl)methylsulfanyl]-6-(methylamino)-N-pyridin-4-ylpyridine-3-carboxamide Traditional Name: 2-[(2,4-dimethoxybenzyl)thio]-6-(methylamino)-N-(4-pyridyl)nicotinamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=C(C=C1)C(=O)NC2=CC=NC=C2)SCC3=C(C=C(C=C3)OC)OC

Isomeric SMILES

CNC1=NC(=C(C=C1)C(=O)NC2=CC=NC=C2)SCC3=C(C=C(C=C3)OC)OC

InChI

InChI=1S/C21H22N4O3S/c1-22-19-7-6-17(20(26)24-15-8-10-23-11-9-15)21(25-19)29-13-14-4-5-16(27-2)12-18(14)28-3/h4-12H,13H2,1-3H3,(H,22,25)(H,23,24,26)