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

Systemtic Name: 5-[(4-ethoxyphenyl)methyl]-2-methyl-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-4-one Openeye Name: 5-[(4-ethoxyphenyl)methyl]-2-methyl-6-[(E)-2-(3-pyridyl)vinyl]-1H-pyrimidin-4-one CAS Name: 5-[(4-ethoxyphenyl)methyl]-2-methyl-6-[(E)-2-(3-pyridinyl)ethenyl]-1H-pyrimidin-4-one IUPAC Name: 5-[(4-ethoxyphenyl)methyl]-2-methyl-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-4-one Traditional Name: 5-(4-ethoxybenzyl)-2-methyl-6-[(E)-2-(3-pyridyl)vinyl]-1H-pyrimidin-4-one Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC2=C(NC(=NC2=O)C)C=CC3=CN=CC=C3

Isomeric SMILES

CCOC1=CC=C(C=C1)CC2=C(NC(=NC2=O)C)/C=C/C3=CN=CC=C3

InChI

InChI=1S/C21H21N3O2/c1-3-26-18-9-6-16(7-10-18)13-19-20(23-15(2)24-21(19)25)11-8-17-5-4-12-22-14-17/h4-12,14H,3,13H2,1-2H3,(H,23,24,25)/b11-8+