2-(5-chloranyl-2-methoxy-phenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(5-chloranyl-2-methoxy-phenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(5-chloro-2-methoxy-phenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-(5-chloro-2-methoxyphenyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(5-chloro-2-methoxyphenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-(5-chloro-2-methoxy-phenyl)-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C17H19ClN4O2 MolecularWeight: 346.81136

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)CC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)CC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C17H19ClN4O2/c1-24-15-4-3-14(18)11-13(15)12-16(23)21-7-9-22(10-8-21)17-19-5-2-6-20-17/h2-6,11H,7-10,12H2,1H3