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

Systemtic Name: 6-[(E)-2-(furan-2-yl)ethenyl]-2-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-1H-pyrimidin-4-one Openeye Name: 6-[(E)-2-(2-furyl)vinyl]-5-(2-isopentylsulfinylethyl)-2-methyl-1H-pyrimidin-4-one CAS Name: 6-[(E)-2-(2-furanyl)ethenyl]-2-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-1H-pyrimidin-4-one IUPAC Name: 6-[(E)-2-(furan-2-yl)ethenyl]-2-methyl-5-[2-(3-methylbutylsulfinyl)ethyl]-1H-pyrimidin-4-one Traditional Name: 6-[(E)-2-(2-furyl)vinyl]-5-(2-isoamylsulfinylethyl)-2-methyl-1H-pyrimidin-4-one Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CC=CO2)CCS(=O)CCC(C)C

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=CC=CO2)CCS(=O)CCC(C)C

InChI

InChI=1S/C18H24N2O3S/c1-13(2)8-11-24(22)12-9-16-17(19-14(3)20-18(16)21)7-6-15-5-4-10-23-15/h4-7,10,13H,8-9,11-12H2,1-3H3,(H,19,20,21)/b7-6+