3-(4-methylphenyl)-5-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-oxadiazole

Systemtic Name: 3-(4-methylphenyl)-5-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-(p-tolyl)-5-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-oxadiazole CAS Name: 3-(4-methylphenyl)-5-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-methylphenyl)-5-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-(p-tolyl)-5-[[4-(2-pyrimidyl)piperazino]methyl]-1,2,4-oxadiazole Formula: C18H20N6O MolecularWeight: 336.391

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C18H20N6O/c1-14-3-5-15(6-4-14)17-21-16(25-22-17)13-23-9-11-24(12-10-23)18-19-7-2-8-20-18/h2-8H,9-13H2,1H3