3-(4-ethanoyl-3-ethoxy-5-oxidanyl-phenyl)-2-ethylsulfanyl-6-pyridin-2-yl-1H-pyridin-4-one

Systemtic Name: 3-(4-ethanoyl-3-ethoxy-5-oxidanyl-phenyl)-2-ethylsulfanyl-6-pyridin-2-yl-1H-pyridin-4-one Openeye Name: 3-(4-acetyl-3-ethoxy-5-hydroxy-phenyl)-2-ethylsulfanyl-6-(2-pyridyl)-1H-pyridin-4-one CAS Name: 3-(4-acetyl-3-ethoxy-5-hydroxyphenyl)-2-(ethylthio)-6-(2-pyridinyl)-1H-pyridin-4-one IUPAC Name: 3-(4-acetyl-3-ethoxy-5-hydroxyphenyl)-2-ethylsulfanyl-6-pyridin-2-yl-1H-pyridin-4-one Traditional Name: 3-(4-acetyl-3-ethoxy-5-hydroxy-phenyl)-2-(ethylthio)-6-(2-pyridyl)-4-pyridone Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C(=O)C)O)C2=C(NC(=CC2=O)C3=CC=CC=N3)SCC

Isomeric SMILES

CCOC1=CC(=CC(=C1C(=O)C)O)C2=C(NC(=CC2=O)C3=CC=CC=N3)SCC

InChI

InChI=1S/C22H22N2O4S/c1-4-28-19-11-14(10-17(26)20(19)13(3)25)21-18(27)12-16(24-22(21)29-5-2)15-8-6-7-9-23-15/h6-12,26H,4-5H2,1-3H3,(H,24,27)