2-methyl-5-pentyl-6-[(E)-2-phenylethenyl]-1H-pyrimidin-4-one

Systemtic Name: 2-methyl-5-pentyl-6-[(E)-2-phenylethenyl]-1H-pyrimidin-4-one Openeye Name: 2-methyl-5-pentyl-6-[(E)-styryl]-1H-pyrimidin-4-one CAS Name: 2-methyl-5-pentyl-6-[(E)-2-phenylethenyl]-1H-pyrimidin-4-one IUPAC Name: 2-methyl-5-pentyl-6-[(E)-2-phenylethenyl]-1H-pyrimidin-4-one Traditional Name: 5-amyl-2-methyl-6-[(E)-styryl]-1H-pyrimidin-4-one Formula: C18H22N2O MolecularWeight: 282.38008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(NC(=NC1=O)C)C=CC2=CC=CC=C2

Isomeric SMILES

CCCCCC1=C(NC(=NC1=O)C)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C18H22N2O/c1-3-4-6-11-16-17(19-14(2)20-18(16)21)13-12-15-9-7-5-8-10-15/h5,7-10,12-13H,3-4,6,11H2,1-2H3,(H,19,20,21)/b13-12+