1-(4-methylphenyl)-2-[6-phenyl-2-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]oxy-ethanone

Systemtic Name: 1-(4-methylphenyl)-2-[6-phenyl-2-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]oxy-ethanone Openeye Name: 2-[6-phenyl-2-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]oxy-1-(p-tolyl)ethanone CAS Name: 1-(4-methylphenyl)-2-[[6-phenyl-2-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]oxy]ethanone IUPAC Name: 1-(4-methylphenyl)-2-[6-phenyl-2-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]oxyethanone Traditional Name: 2-[6-phenyl-2-(4-phenylpiperazino)pyrimidin-4-yl]oxy-1-(p-tolyl)ethanone Formula: C29H28N4O2 MolecularWeight: 464.55822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)COC2=NC(=NC(=C2)C3=CC=CC=C3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)COC2=NC(=NC(=C2)C3=CC=CC=C3)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C29H28N4O2/c1-22-12-14-24(15-13-22)27(34)21-35-28-20-26(23-8-4-2-5-9-23)30-29(31-28)33-18-16-32(17-19-33)25-10-6-3-7-11-25/h2-15,20H,16-19,21H2,1H3