2-[4-(2-methylpropoxy)phenyl]-4-oxidanyl-5-(phenylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[4-(2-methylpropoxy)phenyl]-4-oxidanyl-5-(phenylmethyl)-1H-pyrimidin-6-one Openeye Name: 5-benzyl-4-hydroxy-2-(4-isobutoxyphenyl)-1H-pyrimidin-6-one CAS Name: 4-hydroxy-2-[4-(2-methylpropoxy)phenyl]-5-(phenylmethyl)-1H-pyrimidin-6-one IUPAC Name: 5-benzyl-4-hydroxy-2-[4-(2-methylpropoxy)phenyl]-1H-pyrimidin-6-one Traditional Name: 5-benzyl-4-hydroxy-2-(4-isobutoxyphenyl)-1H-pyrimidin-6-one Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C2=NC(=C(C(=O)N2)CC3=CC=CC=C3)O

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C2=NC(=C(C(=O)N2)CC3=CC=CC=C3)O

InChI

InChI=1S/C21H22N2O3/c1-14(2)13-26-17-10-8-16(9-11-17)19-22-20(24)18(21(25)23-19)12-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3,(H2,22,23,24,25)