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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=O)N1CC(C)(C)C)CCC2=CC=CC=C2)C3=CC=CC=C3O

Isomeric SMILES

CC1=NC(=C(C(=O)N1CC(C)(C)C)CCC2=CC=CC=C2)C3=CC=CC=C3O

InChI

InChI=1S/C24H28N2O2/c1-17-25-22(19-12-8-9-13-21(19)27)20(15-14-18-10-6-5-7-11-18)23(28)26(17)16-24(2,3)4/h5-13,27H,14-16H2,1-4H3