1-[4-(3-methylphenyl)piperazin-1-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 1-[4-(3-methylphenyl)piperazin-1-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 1-[4-(m-tolyl)piperazin-1-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 1-[4-(3-methylphenyl)-1-piperazinyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 1-[4-(3-methylphenyl)piperazin-1-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 1-[4-(m-tolyl)piperazino]-2-[4-(2-pyrimidyl)piperazino]ethanone Formula: C21H28N6O MolecularWeight: 380.48662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H28N6O/c1-18-4-2-5-19(16-18)25-12-14-26(15-13-25)20(28)17-24-8-10-27(11-9-24)21-22-6-3-7-23-21/h2-7,16H,8-15,17H2,1H3