3-(3,5-dimethoxyphenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(3,5-dimethoxyphenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(3,5-dimethoxyphenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-(3,5-dimethoxyphenyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(3,5-dimethoxyphenyl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-(3,5-dimethoxyphenyl)-1-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C19H24N4O3 MolecularWeight: 356.41886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CCC(=O)N2CCN(CC2)C3=NC=CC=N3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CCC(=O)N2CCN(CC2)C3=NC=CC=N3)OC

InChI

InChI=1S/C19H24N4O3/c1-25-16-12-15(13-17(14-16)26-2)4-5-18(24)22-8-10-23(11-9-22)19-20-6-3-7-21-19/h3,6-7,12-14H,4-5,8-11H2,1-2H3