2-[(2,4-dimethylphenyl)methyl]-6-methyl-5-octyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(2,4-dimethylphenyl)methyl]-6-methyl-5-octyl-1H-pyrimidin-4-one Openeye Name: 2-[(2,4-dimethylphenyl)methyl]-6-methyl-5-octyl-1H-pyrimidin-4-one CAS Name: 2-[(2,4-dimethylphenyl)methyl]-6-methyl-5-octyl-1H-pyrimidin-4-one IUPAC Name: 2-[(2,4-dimethylphenyl)methyl]-6-methyl-5-octyl-1H-pyrimidin-4-one Traditional Name: 2-(2,4-dimethylbenzyl)-6-methyl-5-octyl-1H-pyrimidin-4-one Formula: C22H32N2O MolecularWeight: 340.50228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(NC(=NC1=O)CC2=C(C=C(C=C2)C)C)C

Isomeric SMILES

CCCCCCCCC1=C(NC(=NC1=O)CC2=C(C=C(C=C2)C)C)C

InChI

InChI=1S/C22H32N2O/c1-5-6-7-8-9-10-11-20-18(4)23-21(24-22(20)25)15-19-13-12-16(2)14-17(19)3/h12-14H,5-11,15H2,1-4H3,(H,23,24,25)