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

Systemtic Name: 2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Openeye Name: 2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole CAS Name: 2-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole IUPAC Name: 2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Traditional Name: 2-[[4-(2-pyrimidyl)piperazino]methyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole Formula: C20H24N6O4 MolecularWeight: 412.44236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)CN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NN=C(O2)CN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H24N6O4/c1-27-15-11-14(12-16(28-2)18(15)29-3)19-24-23-17(30-19)13-25-7-9-26(10-8-25)20-21-5-4-6-22-20/h4-6,11-12H,7-10,13H2,1-3H3