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

Systemtic Name: 5-(2-butylsulfinylethyl)-2-methyl-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-4-one Openeye Name: 5-(2-butylsulfinylethyl)-2-methyl-6-[(E)-2-(4-pyridyl)vinyl]-1H-pyrimidin-4-one CAS Name: 5-(2-butylsulfinylethyl)-2-methyl-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-4-one IUPAC Name: 5-(2-butylsulfinylethyl)-2-methyl-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-4-one Traditional Name: 5-(2-butylsulfinylethyl)-2-methyl-6-[(E)-2-(4-pyridyl)vinyl]-1H-pyrimidin-4-one Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O2S/c1-3-4-12-24(23)13-9-16-17(20-14(2)21-18(16)22)6-5-15-7-10-19-11-8-15/h5-8,10-11H,3-4,9,12-13H2,1-2H3,(H,20,21,22)/b6-5+