5-[(2,5-dimethylphenyl)methyl]-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-4-one

Systemtic Name: 5-[(2,5-dimethylphenyl)methyl]-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-4-one Openeye Name: 5-[(2,5-dimethylphenyl)methyl]-6-[(E)-2-(3-pyridyl)vinyl]-1H-pyrimidin-4-one CAS Name: 5-[(2,5-dimethylphenyl)methyl]-6-[(E)-2-(3-pyridinyl)ethenyl]-1H-pyrimidin-4-one IUPAC Name: 5-[(2,5-dimethylphenyl)methyl]-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-4-one Traditional Name: 5-(2,5-dimethylbenzyl)-6-[(E)-2-(3-pyridyl)vinyl]-1H-pyrimidin-4-one Formula: C20H19N3O MolecularWeight: 317.38436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CC2=C(NC=NC2=O)C=CC3=CN=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)CC2=C(NC=NC2=O)/C=C/C3=CN=CC=C3

InChI

InChI=1S/C20H19N3O/c1-14-5-6-15(2)17(10-14)11-18-19(22-13-23-20(18)24)8-7-16-4-3-9-21-12-16/h3-10,12-13H,11H2,1-2H3,(H,22,23,24)/b8-7+