6-(4-ethoxyphenyl)-3-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]pyrimidin-4-one

Systemtic Name: 6-(4-ethoxyphenyl)-3-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]pyrimidin-4-one Openeye Name: 3-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-6-(4-ethoxyphenyl)pyrimidin-4-one CAS Name: 6-(4-ethoxyphenyl)-3-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-4-pyrimidinone IUPAC Name: 3-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-6-(4-ethoxyphenyl)pyrimidin-4-one Traditional Name: 3-[2-(4-benzylpiperazino)-2-keto-ethyl]-6-p-phenetyl-pyrimidin-4-one Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C25H28N4O3/c1-2-32-22-10-8-21(9-11-22)23-16-24(30)29(19-26-23)18-25(31)28-14-12-27(13-15-28)17-20-6-4-3-5-7-20/h3-11,16,19H,2,12-15,17-18H2,1H3