6-(2-hydroxyphenyl)-2-methyl-3-(3-methylbutyl)-5-phenethyl-pyrimidin-4-one

Systemtic Name: 6-(2-hydroxyphenyl)-2-methyl-3-(3-methylbutyl)-5-phenethyl-pyrimidin-4-one Openeye Name: 6-(2-hydroxyphenyl)-3-isopentyl-2-methyl-5-phenethyl-pyrimidin-4-one CAS Name: 6-(2-hydroxyphenyl)-2-methyl-3-(3-methylbutyl)-5-phenethyl-4-pyrimidinone IUPAC Name: 6-(2-hydroxyphenyl)-2-methyl-3-(3-methylbutyl)-5-phenethylpyrimidin-4-one Traditional Name: 6-(2-hydroxyphenyl)-3-isoamyl-2-methyl-5-phenethyl-pyrimidin-4-one Formula: C24H28N2O2 MolecularWeight: 376.49132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=O)N1CCC(C)C)CCC2=CC=CC=C2)C3=CC=CC=C3O

Isomeric SMILES

CC1=NC(=C(C(=O)N1CCC(C)C)CCC2=CC=CC=C2)C3=CC=CC=C3O

InChI

InChI=1S/C24H28N2O2/c1-17(2)15-16-26-18(3)25-23(20-11-7-8-12-22(20)27)21(24(26)28)14-13-19-9-5-4-6-10-19/h4-12,17,27H,13-16H2,1-3H3