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

Systemtic Name: 5-butyl-2-methyl-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-4-one Openeye Name: 5-butyl-2-methyl-6-[(E)-2-(3-pyridyl)vinyl]-1H-pyrimidin-4-one CAS Name: 5-butyl-2-methyl-6-[(E)-2-(3-pyridinyl)ethenyl]-1H-pyrimidin-4-one IUPAC Name: 5-butyl-2-methyl-6-[(E)-2-pyridin-3-ylethenyl]-1H-pyrimidin-4-one Traditional Name: 5-butyl-2-methyl-6-[(E)-2-(3-pyridyl)vinyl]-1H-pyrimidin-4-one Formula: C16H19N3O MolecularWeight: 269.34156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=NC1=O)C)C=CC2=CN=CC=C2

Isomeric SMILES

CCCCC1=C(NC(=NC1=O)C)/C=C/C2=CN=CC=C2

InChI

InChI=1S/C16H19N3O/c1-3-4-7-14-15(18-12(2)19-16(14)20)9-8-13-6-5-10-17-11-13/h5-6,8-11H,3-4,7H2,1-2H3,(H,18,19,20)/b9-8+