6-[1-ethanoyl-4-(phenylmethyl)piperazin-2-yl]-2-pyridin-4-yl-1H-pyrimidin-4-one

Systemtic Name: 6-[1-ethanoyl-4-(phenylmethyl)piperazin-2-yl]-2-pyridin-4-yl-1H-pyrimidin-4-one Openeye Name: 6-(1-acetyl-4-benzyl-piperazin-2-yl)-2-(4-pyridyl)-1H-pyrimidin-4-one CAS Name: 6-[1-acetyl-4-(phenylmethyl)-2-piperazinyl]-2-pyridin-4-yl-1H-pyrimidin-4-one IUPAC Name: 6-(1-acetyl-4-benzylpiperazin-2-yl)-2-pyridin-4-yl-1H-pyrimidin-4-one Traditional Name: 6-(1-acetyl-4-benzyl-piperazin-2-yl)-2-(4-pyridyl)-1H-pyrimidin-4-one Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1C2=CC(=O)N=C(N2)C3=CC=NC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCN(CC1C2=CC(=O)N=C(N2)C3=CC=NC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H23N5O2/c1-16(28)27-12-11-26(14-17-5-3-2-4-6-17)15-20(27)19-13-21(29)25-22(24-19)18-7-9-23-10-8-18/h2-10,13,20H,11-12,14-15H2,1H3,(H,24,25,29)