2-methyl-5-(2-pentylsulfinylethyl)-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-4-one

Systemtic Name: 2-methyl-5-(2-pentylsulfinylethyl)-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-4-one Openeye Name: 2-methyl-5-(2-pentylsulfinylethyl)-6-[(E)-2-(4-pyridyl)vinyl]-1H-pyrimidin-4-one CAS Name: 2-methyl-5-(2-pentylsulfinylethyl)-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-4-one IUPAC Name: 2-methyl-5-(2-pentylsulfinylethyl)-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-4-one Traditional Name: 5-(2-amylsulfinylethyl)-2-methyl-6-[(E)-2-(4-pyridyl)vinyl]-1H-pyrimidin-4-one Formula: C19H25N3O2S MolecularWeight: 359.4857

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)CCC1=C(NC(=NC1=O)C)C=CC2=CC=NC=C2

Isomeric SMILES

CCCCCS(=O)CCC1=C(NC(=NC1=O)C)/C=C/C2=CC=NC=C2

InChI

InChI=1S/C19H25N3O2S/c1-3-4-5-13-25(24)14-10-17-18(21-15(2)22-19(17)23)7-6-16-8-11-20-12-9-16/h6-9,11-12H,3-5,10,13-14H2,1-2H3,(H,21,22,23)/b7-6+