6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-1H-pyrimidin-4-one

Systemtic Name: 6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-1H-pyrimidin-4-one Openeye Name: 6-[(E)-2-(4-hydroxyphenyl)vinyl]-5-(2-isopentylsulfinylethyl)-2-methyl-1H-pyrimidin-4-one CAS Name: 6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-1H-pyrimidin-4-one IUPAC Name: 6-[(E)-2-(4-hydroxyphenyl)ethenyl]-2-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-1H-pyrimidin-4-one Traditional Name: 6-[(E)-2-(4-hydroxyphenyl)vinyl]-5-(2-isoamylsulfinylethyl)-2-methyl-1H-pyrimidin-4-one Formula: C20H26N2O3S MolecularWeight: 374.49704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CC=C(C=C2)O)CCS(=O)CCC(C)C

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=CC=C(C=C2)O)CCS(=O)CCC(C)C

InChI

InChI=1S/C20H26N2O3S/c1-14(2)10-12-26(25)13-11-18-19(21-15(3)22-20(18)24)9-6-16-4-7-17(23)8-5-16/h4-9,14,23H,10-13H2,1-3H3,(H,21,22,24)/b9-6+