2-[5-methoxy-4-oxidanylidene-2-(pyrimidin-2-ylsulfanylmethyl)pyridin-1-yl]-N-(3-methoxyphenyl)ethanamide

Systemtic Name: 2-[5-methoxy-4-oxidanylidene-2-(pyrimidin-2-ylsulfanylmethyl)pyridin-1-yl]-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-[5-methoxy-4-oxo-2-(pyrimidin-2-ylsulfanylmethyl)-1-pyridyl]-N-(3-methoxyphenyl)acetamide CAS Name: 2-[5-methoxy-4-oxo-2-[(2-pyrimidinylthio)methyl]-1-pyridinyl]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-[5-methoxy-4-oxo-2-(pyrimidin-2-ylsulfanylmethyl)pyridin-1-yl]-N-(3-methoxyphenyl)acetamide Traditional Name: 2-[4-keto-5-methoxy-2-[(2-pyrimidylthio)methyl]-1-pyridyl]-N-(3-methoxyphenyl)acetamide Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CN2C=C(C(=O)C=C2CSC3=NC=CC=N3)OC

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CN2C=C(C(=O)C=C2CSC3=NC=CC=N3)OC

InChI

InChI=1S/C20H20N4O4S/c1-27-16-6-3-5-14(9-16)23-19(26)12-24-11-18(28-2)17(25)10-15(24)13-29-20-21-7-4-8-22-20/h3-11H,12-13H2,1-2H3,(H,23,26)