5-(2-ethylsulfanylethyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-methyl-1H-pyrimidin-4-one

Systemtic Name: 5-(2-ethylsulfanylethyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-methyl-1H-pyrimidin-4-one Openeye Name: 5-(2-ethylsulfanylethyl)-6-[(E)-2-(4-hydroxyphenyl)vinyl]-2-methyl-1H-pyrimidin-4-one CAS Name: 5-[2-(ethylthio)ethyl]-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-methyl-1H-pyrimidin-4-one IUPAC Name: 5-(2-ethylsulfanylethyl)-6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-methyl-1H-pyrimidin-4-one Traditional Name: 5-[2-(ethylthio)ethyl]-6-[(E)-2-(4-hydroxyphenyl)vinyl]-2-methyl-1H-pyrimidin-4-one Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCC1=C(NC(=NC1=O)C)C=CC2=CC=C(C=C2)O

Isomeric SMILES

CCSCCC1=C(NC(=NC1=O)C)/C=C/C2=CC=C(C=C2)O

InChI

InChI=1S/C17H20N2O2S/c1-3-22-11-10-15-16(18-12(2)19-17(15)21)9-6-13-4-7-14(20)8-5-13/h4-9,20H,3,10-11H2,1-2H3,(H,18,19,21)/b9-6+