2-[[4-methoxy-2-(methoxymethoxy)phenyl]methylsulfinyl]-N-pyridin-4-yl-pyridine-3-carboxamide

Systemtic Name: 2-[[4-methoxy-2-(methoxymethoxy)phenyl]methylsulfinyl]-N-pyridin-4-yl-pyridine-3-carboxamide Openeye Name: 2-[[4-methoxy-2-(methoxymethoxy)phenyl]methylsulfinyl]-N-(4-pyridyl)pyridine-3-carboxamide CAS Name: 2-[[4-methoxy-2-(methoxymethoxy)phenyl]methylsulfinyl]-N-pyridin-4-yl-3-pyridinecarboxamide IUPAC Name: 2-[[4-methoxy-2-(methoxymethoxy)phenyl]methylsulfinyl]-N-pyridin-4-ylpyridine-3-carboxamide Traditional Name: 2-[4-methoxy-2-(methoxymethoxy)benzyl]sulfinyl-N-(4-pyridyl)nicotinamide Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1=C(C=CC(=C1)OC)CS(=O)C2=C(C=CC=N2)C(=O)NC3=CC=NC=C3

Isomeric SMILES

COCOC1=C(C=CC(=C1)OC)CS(=O)C2=C(C=CC=N2)C(=O)NC3=CC=NC=C3

InChI

InChI=1S/C21H21N3O5S/c1-27-14-29-19-12-17(28-2)6-5-15(19)13-30(26)21-18(4-3-9-23-21)20(25)24-16-7-10-22-11-8-16/h3-12H,13-14H2,1-2H3,(H,22,24,25)