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

Systemtic Name: 5-(2-cyclopentylsulfinylethyl)-6-[(E)-2-(4-methoxyphenyl)ethenyl]-2-methyl-1H-pyrimidin-4-one Openeye Name: 5-(2-cyclopentylsulfinylethyl)-6-[(E)-2-(4-methoxyphenyl)vinyl]-2-methyl-1H-pyrimidin-4-one CAS Name: 5-(2-cyclopentylsulfinylethyl)-6-[(E)-2-(4-methoxyphenyl)ethenyl]-2-methyl-1H-pyrimidin-4-one IUPAC Name: 5-(2-cyclopentylsulfinylethyl)-6-[(E)-2-(4-methoxyphenyl)ethenyl]-2-methyl-1H-pyrimidin-4-one Traditional Name: 5-(2-cyclopentylsulfinylethyl)-6-[(E)-2-(4-methoxyphenyl)vinyl]-2-methyl-1H-pyrimidin-4-one Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CC=C(C=C2)OC)CCS(=O)C3CCCC3

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3S/c1-15-22-20(12-9-16-7-10-17(26-2)11-8-16)19(21(24)23-15)13-14-27(25)18-5-3-4-6-18/h7-12,18H,3-6,13-14H2,1-2H3,(H,22,23,24)/b12-9+