2-(4-butoxyphenyl)-4-oxidanyl-5-(phenylmethyl)-1H-pyrimidin-6-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC(=C(C(=O)N2)CC3=CC=CC=C3)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC(=C(C(=O)N2)CC3=CC=CC=C3)O

InChI

InChI=1S/C21H22N2O3/c1-2-3-13-26-17-11-9-16(10-12-17)19-22-20(24)18(21(25)23-19)14-15-7-5-4-6-8-15/h4-12H,2-3,13-14H2,1H3,(H2,22,23,24,25)