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

Systemtic Name: 5-(2-cyclopentylsulfinylethyl)-6-[(E)-2-(furan-2-yl)ethenyl]-2-methyl-1H-pyrimidin-4-one Openeye Name: 5-(2-cyclopentylsulfinylethyl)-6-[(E)-2-(2-furyl)vinyl]-2-methyl-1H-pyrimidin-4-one CAS Name: 5-(2-cyclopentylsulfinylethyl)-6-[(E)-2-(2-furanyl)ethenyl]-2-methyl-1H-pyrimidin-4-one IUPAC Name: 5-(2-cyclopentylsulfinylethyl)-6-[(E)-2-(furan-2-yl)ethenyl]-2-methyl-1H-pyrimidin-4-one Traditional Name: 5-(2-cyclopentylsulfinylethyl)-6-[(E)-2-(2-furyl)vinyl]-2-methyl-1H-pyrimidin-4-one Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CC=CO2)CCS(=O)C3CCCC3

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=CC=CO2)CCS(=O)C3CCCC3

InChI

InChI=1S/C18H22N2O3S/c1-13-19-17(9-8-14-5-4-11-23-14)16(18(21)20-13)10-12-24(22)15-6-2-3-7-15/h4-5,8-9,11,15H,2-3,6-7,10,12H2,1H3,(H,19,20,21)/b9-8+